Search Result : Detailed Informations

Low Mol Weight Allergen Name	CAS#	CID
2-[N-(2-Hydroxyethyl)-4-methyl-3-[(4-nitrophenyl)diazenyl]anilino]ethanol		18513

Structure

Other Information

Canonical SMILES	CC1=C(C=C(C=C1)N(CCO)CCO)N=NC2=CC=C(C=C2)[N+](=O)[O-]
Iso SMILES	CC1=C(C=C(C=C1)N(CCO)CCO)N=NC2=CC=C(C=C2)[N+](=O)[O-]
InChI	InChI=1S/C17H20N4O4/c1-13-2-5-16(20(8-10-22)9-11-23)12-17(13)19-18-14-3-6-15(7-4-14)21(24)25/h2-7,12,22-23H,8-11H2,1H3
InChI Key	ZGFGZIIGLDISMQ-UHFFFAOYSA-N
Formula	C17H20N4O4
Mol Weight	344.365
XlogP3	2.6
Charge	0

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Synonyms Information

CAS Name	2-[N-(2-hydroxyethyl)-4-methyl-3-(4-nitrophenyl)azoanilino]ethanol
IUPAC Name	2-[N-(2-hydroxyethyl)-4-methyl-3-(4-nitrophenyl)azo-anilino]ethanol
Openeye Name	2-[N-(2-hydroxyethyl)-4-methyl-3-[(4-nitrophenyl)diazenyl]anilino]ethanol
Systematic Name	2-[2-hydroxyethyl-[4-methyl-3-[(4-nitrophenyl)diazenyl]phenyl]amino]ethanol
Tratitional Name	2-[2-hydroxyethyl-[4-methyl-3-[(4-nitrophenyl)diazenyl]phenyl]amino]ethanol