(Z)-4-oxidanylidene-2-phenyl-4-(undecylamino)but-2-enoic acid

Systemtic Name: (Z)-4-oxidanylidene-2-phenyl-4-(undecylamino)but-2-enoic acid Openeye Name: (Z)-4-oxo-2-phenyl-4-(undecylamino)but-2-enoic acid CAS Name: (Z)-4-oxo-2-phenyl-4-(undecylamino)-2-butenoic acid IUPAC Name: (Z)-4-oxo-2-phenyl-4-(undecylamino)but-2-enoic acid Traditional Name: (Z)-4-keto-2-phenyl-4-(undecylamino)but-2-enoic acid Formula: C21H31NO3 MolecularWeight: 345.47574

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCNC(=O)C=C(C1=CC=CC=C1)C(=O)O

Isomeric SMILES

CCCCCCCCCCCNC(=O)/C=C(/C1=CC=CC=C1)\C(=O)O

InChI

InChI=1S/C21H31NO3/c1-2-3-4-5-6-7-8-9-13-16-22-20(23)17-19(21(24)25)18-14-11-10-12-15-18/h10-12,14-15,17H,2-9,13,16H2,1H3,(H,22,23)(H,24,25)/b19-17-