2-[[4-chloranyl-2-(4-methoxyphenyl)carbonyl-phenyl]diazenyl]-3-oxidanylidene-butanoate

Systemtic Name: 2-[[4-chloranyl-2-(4-methoxyphenyl)carbonyl-phenyl]diazenyl]-3-oxidanylidene-butanoate Openeye Name: 2-[4-chloro-2-(4-methoxybenzoyl)phenyl]azo-3-oxo-butanoate CAS Name: 2-[4-chloro-2-[(4-methoxyphenyl)-oxomethyl]phenyl]azo-3-oxobutanoate IUPAC Name: 2-[[4-chloro-2-(4-methoxybenzoyl)phenyl]diazenyl]-3-oxobutanoate Traditional Name: 2-(4-chloro-2-p-anisoyl-phenyl)azo-3-keto-butyrate Formula: C18H14ClN2O5- MolecularWeight: 373.76716

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(C(=O)[O-])N=NC1=C(C=C(C=C1)Cl)C(=O)C2=CC=C(C=C2)OC

Isomeric SMILES

CC(=O)C(C(=O)[O-])N=NC1=C(C=C(C=C1)Cl)C(=O)C2=CC=C(C=C2)OC

InChI

InChI=1S/C18H15ClN2O5/c1-10(22)16(18(24)25)21-20-15-8-5-12(19)9-14(15)17(23)11-3-6-13(26-2)7-4-11/h3-9,16H,1-2H3,(H,24,25)/p-1