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

Systemtic Name: 4-oxidanylidene-2-(3-oxidanylpropylamino)-4-[(4-phenoxyphenyl)amino]butanoic acid Openeye Name: 2-(3-hydroxypropylamino)-4-oxo-4-(4-phenoxyanilino)butanoic acid CAS Name: 2-(3-hydroxypropylamino)-4-oxo-4-(4-phenoxyanilino)butanoic acid IUPAC Name: 2-(3-hydroxypropylamino)-4-oxo-4-(4-phenoxyanilino)butanoic acid Traditional Name: 2-(3-hydroxypropylamino)-4-keto-4-(4-phenoxyanilino)butyric acid Formula: C19H22N2O5 MolecularWeight: 358.38838

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=O)CC(C(=O)O)NCCCO

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=O)CC(C(=O)O)NCCCO

InChI

InChI=1S/C19H22N2O5/c22-12-4-11-20-17(19(24)25)13-18(23)21-14-7-9-16(10-8-14)26-15-5-2-1-3-6-15/h1-3,5-10,17,20,22H,4,11-13H2,(H,21,23)(H,24,25)