[2-[(4-chlorophenyl)methylamino]-2-oxidanylidene-ethyl] 2-[(4-fluorophenyl)carbonylamino]-3-(1H-indol-3-yl)propanoate

Systemtic Name: [2-[(4-chlorophenyl)methylamino]-2-oxidanylidene-ethyl] 2-[(4-fluorophenyl)carbonylamino]-3-(1H-indol-3-yl)propanoate Openeye Name: [2-[(4-chlorophenyl)methylamino]-2-oxo-ethyl] 2-[(4-fluorobenzoyl)amino]-3-(1H-indol-3-yl)propanoate CAS Name: 2-[[(4-fluorophenyl)-oxomethyl]amino]-3-(1H-indol-3-yl)propanoic acid [2-[(4-chlorophenyl)methylamino]-2-oxoethyl] ester IUPAC Name: [2-[(4-chlorophenyl)methylamino]-2-oxoethyl] 2-[(4-fluorobenzoyl)amino]-3-(1H-indol-3-yl)propanoate Traditional Name: 2-[(4-fluorobenzoyl)amino]-3-(1H-indol-3-yl)propionic acid [2-[(4-chlorobenzyl)amino]-2-keto-ethyl] ester Formula: C27H23ClFN3O4 MolecularWeight: 507.940623

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)CC(C(=O)OCC(=O)NCC3=CC=C(C=C3)Cl)NC(=O)C4=CC=C(C=C4)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)CC(C(=O)OCC(=O)NCC3=CC=C(C=C3)Cl)NC(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C27H23ClFN3O4/c28-20-9-5-17(6-10-20)14-31-25(33)16-36-27(35)24(32-26(34)18-7-11-21(29)12-8-18)13-19-15-30-23-4-2-1-3-22(19)23/h1-12,15,24,30H,13-14,16H2,(H,31,33)(H,32,34)