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

Systemtic Name: 4-[(4-hexylphenyl)amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-(4-hexylanilino)-4-oxo-butanoic acid CAS Name: 4-(4-hexylanilino)-4-oxobutanoic acid IUPAC Name: 4-(4-hexylanilino)-4-oxobutanoic acid Traditional Name: 4-(4-hexylanilino)-4-keto-butyric acid Formula: C16H23NO3 MolecularWeight: 277.35872

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)NC(=O)CCC(=O)O

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)NC(=O)CCC(=O)O

InChI

InChI=1S/C16H23NO3/c1-2-3-4-5-6-13-7-9-14(10-8-13)17-15(18)11-12-16(19)20/h7-10H,2-6,11-12H2,1H3,(H,17,18)(H,19,20)