quinolin-8-ylmethyl (3S)-3-[(2-chlorophenyl)carbonylamino]-3-phenyl-propanoate

Systemtic Name: quinolin-8-ylmethyl (3S)-3-[(2-chlorophenyl)carbonylamino]-3-phenyl-propanoate Openeye Name: 8-quinolylmethyl (3S)-3-[(2-chlorobenzoyl)amino]-3-phenyl-propanoate CAS Name: (3S)-3-[[(2-chlorophenyl)-oxomethyl]amino]-3-phenylpropanoic acid 8-quinolinylmethyl ester IUPAC Name: quinolin-8-ylmethyl (3S)-3-[(2-chlorobenzoyl)amino]-3-phenylpropanoate Traditional Name: (3S)-3-[(2-chlorobenzoyl)amino]-3-phenyl-propionic acid 8-quinolylmethyl ester Formula: C26H21ClN2O3 MolecularWeight: 444.90954

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CC(=O)OCC2=CC=CC3=C2N=CC=C3)NC(=O)C4=CC=CC=C4Cl

Isomeric SMILES

C1=CC=C(C=C1)[C@H](CC(=O)OCC2=CC=CC3=C2N=CC=C3)NC(=O)C4=CC=CC=C4Cl

InChI

InChI=1S/C26H21ClN2O3/c27-22-14-5-4-13-21(22)26(31)29-23(18-8-2-1-3-9-18)16-24(30)32-17-20-11-6-10-19-12-7-15-28-25(19)20/h1-15,23H,16-17H2,(H,29,31)/t23-/m0/s1