(E)-4-[(2-hexoxycarbonylphenyl)amino]-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (E)-4-[(2-hexoxycarbonylphenyl)amino]-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-(2-hexoxycarbonylanilino)-4-oxo-but-2-enoic acid CAS Name: (E)-4-[2-[hexoxy(oxo)methyl]anilino]-4-oxo-2-butenoic acid IUPAC Name: (E)-4-(2-hexoxycarbonylanilino)-4-oxobut-2-enoic acid Traditional Name: (E)-4-(2-hexoxycarbonylanilino)-4-keto-but-2-enoic acid Formula: C17H21NO5 MolecularWeight: 319.35234

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)C1=CC=CC=C1NC(=O)C=CC(=O)O

Isomeric SMILES

CCCCCCOC(=O)C1=CC=CC=C1NC(=O)/C=C/C(=O)O

InChI

InChI=1S/C17H21NO5/c1-2-3-4-7-12-23-17(22)13-8-5-6-9-14(13)18-15(19)10-11-16(20)21/h5-6,8-11H,2-4,7,12H2,1H3,(H,18,19)(H,20,21)/b11-10+