4-[(4-decoxycarbonylphenyl)amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[(4-decoxycarbonylphenyl)amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-(4-decoxycarbonylanilino)-4-oxo-butanoic acid CAS Name: 4-[4-[decoxy(oxo)methyl]anilino]-4-oxobutanoic acid IUPAC Name: 4-(4-decoxycarbonylanilino)-4-oxobutanoic acid Traditional Name: 4-(4-decoxycarbonylanilino)-4-keto-butyric acid Formula: C21H31NO5 MolecularWeight: 377.47454

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC(=O)C1=CC=C(C=C1)NC(=O)CCC(=O)O

Isomeric SMILES

CCCCCCCCCCOC(=O)C1=CC=C(C=C1)NC(=O)CCC(=O)O

InChI

InChI=1S/C21H31NO5/c1-2-3-4-5-6-7-8-9-16-27-21(26)17-10-12-18(13-11-17)22-19(23)14-15-20(24)25/h10-13H,2-9,14-16H2,1H3,(H,22,23)(H,24,25)