(E)-4-[(3-heptoxyphenyl)amino]-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (E)-4-[(3-heptoxyphenyl)amino]-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-(3-heptoxyanilino)-4-oxo-but-2-enoic acid CAS Name: (E)-4-(3-heptoxyanilino)-4-oxo-2-butenoic acid IUPAC Name: (E)-4-(3-heptoxyanilino)-4-oxobut-2-enoic acid Traditional Name: (E)-4-(3-heptoxyanilino)-4-keto-but-2-enoic acid Formula: C17H23NO4 MolecularWeight: 305.36882

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=CC(=C1)NC(=O)C=CC(=O)O

Isomeric SMILES

CCCCCCCOC1=CC=CC(=C1)NC(=O)/C=C/C(=O)O

InChI

InChI=1S/C17H23NO4/c1-2-3-4-5-6-12-22-15-9-7-8-14(13-15)18-16(19)10-11-17(20)21/h7-11,13H,2-6,12H2,1H3,(H,18,19)(H,20,21)/b11-10+