2-[[3-oxidanylidene-1-(3-phenylpropanoyl)-2-propyl-2,4-dihydroquinoxalin-6-yl]carbonylamino]-3-phenyl-propanoic acid

Systemtic Name: 2-[[3-oxidanylidene-1-(3-phenylpropanoyl)-2-propyl-2,4-dihydroquinoxalin-6-yl]carbonylamino]-3-phenyl-propanoic acid Openeye Name: 2-[[3-oxo-1-(3-phenylpropanoyl)-2-propyl-2,4-dihydroquinoxaline-6-carbonyl]amino]-3-phenyl-propanoic acid CAS Name: 2-[[oxo-[3-oxo-1-(1-oxo-3-phenylpropyl)-2-propyl-2,4-dihydroquinoxalin-6-yl]methyl]amino]-3-phenylpropanoic acid IUPAC Name: 2-[[3-oxo-1-(3-phenylpropanoyl)-2-propyl-2,4-dihydroquinoxaline-6-carbonyl]amino]-3-phenylpropanoic acid Traditional Name: 2-[(1-hydrocinnamoyl-3-keto-2-propyl-2,4-dihydroquinoxaline-6-carbonyl)amino]-3-phenyl-propionic acid Formula: C30H31N3O5 MolecularWeight: 513.58424

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1C(=O)NC2=C(N1C(=O)CCC3=CC=CC=C3)C=CC(=C2)C(=O)NC(CC4=CC=CC=C4)C(=O)O

Isomeric SMILES

CCCC1C(=O)NC2=C(N1C(=O)CCC3=CC=CC=C3)C=CC(=C2)C(=O)NC(CC4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C30H31N3O5/c1-2-9-26-29(36)31-23-19-22(28(35)32-24(30(37)38)18-21-12-7-4-8-13-21)15-16-25(23)33(26)27(34)17-14-20-10-5-3-6-11-20/h3-8,10-13,15-16,19,24,26H,2,9,14,17-18H2,1H3,(H,31,36)(H,32,35)(H,37,38)