(2R)-2-[ethanoyl-(phenylmethyl)amino]-3-(1H-indol-3-yl)-2-methyl-4-phenyl-butanoic acid

Systemtic Name: (2R)-2-[ethanoyl-(phenylmethyl)amino]-3-(1H-indol-3-yl)-2-methyl-4-phenyl-butanoic acid Openeye Name: (2R)-2-[acetyl(benzyl)amino]-3-(1H-indol-3-yl)-2-methyl-4-phenyl-butanoic acid CAS Name: (2R)-2-[acetyl-(phenylmethyl)amino]-3-(1H-indol-3-yl)-2-methyl-4-phenylbutanoic acid IUPAC Name: (2R)-2-[acetyl(benzyl)amino]-3-(1H-indol-3-yl)-2-methyl-4-phenylbutanoic acid Traditional Name: (2R)-2-[acetyl(benzyl)amino]-3-(1H-indol-3-yl)-2-methyl-4-phenyl-butyric acid Formula: C28H28N2O3 MolecularWeight: 440.53352

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(CC1=CC=CC=C1)C(C)(C(CC2=CC=CC=C2)C3=CNC4=CC=CC=C43)C(=O)O

Isomeric SMILES

CC(=O)N(CC1=CC=CC=C1)[C@](C)(C(CC2=CC=CC=C2)C3=CNC4=CC=CC=C43)C(=O)O

InChI

InChI=1S/C28H28N2O3/c1-20(31)30(19-22-13-7-4-8-14-22)28(2,27(32)33)25(17-21-11-5-3-6-12-21)24-18-29-26-16-10-9-15-23(24)26/h3-16,18,25,29H,17,19H2,1-2H3,(H,32,33)/t25?,28-/m1/s1