methyl (2R)-2-[(3-benzamido-3-phenyl-propanoyl)amino]-3-(1H-indol-3-yl)propanoate

Systemtic Name: methyl (2R)-2-[(3-benzamido-3-phenyl-propanoyl)amino]-3-(1H-indol-3-yl)propanoate Openeye Name: methyl (2R)-2-[(3-benzamido-3-phenyl-propanoyl)amino]-3-(1H-indol-3-yl)propanoate CAS Name: (2R)-2-[(3-benzamido-1-oxo-3-phenylpropyl)amino]-3-(1H-indol-3-yl)propanoic acid methyl ester IUPAC Name: methyl (2R)-2-[(3-benzamido-3-phenylpropanoyl)amino]-3-(1H-indol-3-yl)propanoate Traditional Name: (2R)-2-[(3-benzamido-3-phenyl-propanoyl)amino]-3-(1H-indol-3-yl)propionic acid methyl ester Formula: C28H27N3O4 MolecularWeight: 469.53168

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CNC2=CC=CC=C21)NC(=O)CC(C3=CC=CC=C3)NC(=O)C4=CC=CC=C4

Isomeric SMILES

COC(=O)[C@@H](CC1=CNC2=CC=CC=C21)NC(=O)CC(C3=CC=CC=C3)NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C28H27N3O4/c1-35-28(34)25(16-21-18-29-23-15-9-8-14-22(21)23)30-26(32)17-24(19-10-4-2-5-11-19)31-27(33)20-12-6-3-7-13-20/h2-15,18,24-25,29H,16-17H2,1H3,(H,30,32)(H,31,33)/t24?,25-/m1/s1