4-[(4-butylphenyl)amino]-4-oxidanylidene-2-(3-oxidanylpropylamino)butanoic acid

Systemtic Name: 4-[(4-butylphenyl)amino]-4-oxidanylidene-2-(3-oxidanylpropylamino)butanoic acid Openeye Name: 4-(4-butylanilino)-2-(3-hydroxypropylamino)-4-oxo-butanoic acid CAS Name: 4-(4-butylanilino)-2-(3-hydroxypropylamino)-4-oxobutanoic acid IUPAC Name: 4-(4-butylanilino)-2-(3-hydroxypropylamino)-4-oxobutanoic acid Traditional Name: 4-(4-butylanilino)-2-(3-hydroxypropylamino)-4-keto-butyric acid Formula: C17H26N2O4 MolecularWeight: 322.39934

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)CC(C(=O)O)NCCCO

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)CC(C(=O)O)NCCCO

InChI

InChI=1S/C17H26N2O4/c1-2-3-5-13-6-8-14(9-7-13)19-16(21)12-15(17(22)23)18-10-4-11-20/h6-9,15,18,20H,2-5,10-12H2,1H3,(H,19,21)(H,22,23)