(phenylmethyl) 3-[[2-[(1-oxidanylidene-4-phenyl-1-phenylmethoxy-butan-2-yl)amino]-3-phenyl-propanoyl]amino]benzoate

Systemtic Name: (phenylmethyl) 3-[[2-[(1-oxidanylidene-4-phenyl-1-phenylmethoxy-butan-2-yl)amino]-3-phenyl-propanoyl]amino]benzoate Openeye Name: benzyl 3-[[2-[(1-benzyloxycarbonyl-3-phenyl-propyl)amino]-3-phenyl-propanoyl]amino]benzoate CAS Name: 3-[[1-oxo-2-[(1-oxo-4-phenyl-1-phenylmethoxybutan-2-yl)amino]-3-phenylpropyl]amino]benzoic acid (phenylmethyl) ester IUPAC Name: benzyl 3-[[2-[(1-oxo-4-phenyl-1-phenylmethoxybutan-2-yl)amino]-3-phenylpropanoyl]amino]benzoate Traditional Name: 3-[[2-[(1-carbobenzoxy-3-phenyl-propyl)amino]-3-phenyl-propanoyl]amino]benzoic acid benzyl ester Formula: C40H38N2O5 MolecularWeight: 626.74012

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC(C(=O)OCC2=CC=CC=C2)NC(CC3=CC=CC=C3)C(=O)NC4=CC=CC(=C4)C(=O)OCC5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)CCC(C(=O)OCC2=CC=CC=C2)NC(CC3=CC=CC=C3)C(=O)NC4=CC=CC(=C4)C(=O)OCC5=CC=CC=C5

InChI

InChI=1S/C40H38N2O5/c43-38(41-35-23-13-22-34(27-35)39(44)46-28-32-18-9-3-10-19-32)37(26-31-16-7-2-8-17-31)42-36(25-24-30-14-5-1-6-15-30)40(45)47-29-33-20-11-4-12-21-33/h1-23,27,36-37,42H,24-26,28-29H2,(H,41,43)