ethyl 3-phenyl-3-[2-[[3-[(phenylmethyl)carbamoylamino]phenyl]carbonylamino]ethanoylamino]propanoate

Systemtic Name: ethyl 3-phenyl-3-[2-[[3-[(phenylmethyl)carbamoylamino]phenyl]carbonylamino]ethanoylamino]propanoate Openeye Name: ethyl 3-[[2-[[3-(benzylcarbamoylamino)benzoyl]amino]acetyl]amino]-3-phenyl-propanoate CAS Name: 3-[[1-oxo-2-[[oxo-[3-[[oxo-[(phenylmethyl)amino]methyl]amino]phenyl]methyl]amino]ethyl]amino]-3-phenylpropanoic acid ethyl ester IUPAC Name: ethyl 3-[[2-[[3-(benzylcarbamoylamino)benzoyl]amino]acetyl]amino]-3-phenylpropanoate Traditional Name: 3-[[2-[[3-(benzylcarbamoylamino)benzoyl]amino]acetyl]amino]-3-phenyl-propionic acid ethyl ester Formula: C28H30N4O5 MolecularWeight: 502.5616

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C1=CC=CC=C1)NC(=O)CNC(=O)C2=CC(=CC=C2)NC(=O)NCC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)CC(C1=CC=CC=C1)NC(=O)CNC(=O)C2=CC(=CC=C2)NC(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C28H30N4O5/c1-2-37-26(34)17-24(21-12-7-4-8-13-21)32-25(33)19-29-27(35)22-14-9-15-23(16-22)31-28(36)30-18-20-10-5-3-6-11-20/h3-16,24H,2,17-19H2,1H3,(H,29,35)(H,32,33)(H2,30,31,36)