methyl 3-(1-methyl-2-phenyl-indol-3-yl)-2-(phenylmethoxycarbonylamino)butanoate

Systemtic Name: methyl 3-(1-methyl-2-phenyl-indol-3-yl)-2-(phenylmethoxycarbonylamino)butanoate Openeye Name: methyl 2-(benzyloxycarbonylamino)-3-(1-methyl-2-phenyl-indol-3-yl)butanoate CAS Name: 3-(1-methyl-2-phenyl-3-indolyl)-2-(phenylmethoxycarbonylamino)butanoic acid methyl ester IUPAC Name: methyl 3-(1-methyl-2-phenylindol-3-yl)-2-(phenylmethoxycarbonylamino)butanoate Traditional Name: 2-(benzyloxycarbonylamino)-3-(1-methyl-2-phenyl-indol-3-yl)butyric acid methyl ester Formula: C28H28N2O4 MolecularWeight: 456.53292

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(N(C2=CC=CC=C21)C)C3=CC=CC=C3)C(C(=O)OC)NC(=O)OCC4=CC=CC=C4

Isomeric SMILES

CC(C1=C(N(C2=CC=CC=C21)C)C3=CC=CC=C3)C(C(=O)OC)NC(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C28H28N2O4/c1-19(25(27(31)33-3)29-28(32)34-18-20-12-6-4-7-13-20)24-22-16-10-11-17-23(22)30(2)26(24)21-14-8-5-9-15-21/h4-17,19,25H,18H2,1-3H3,(H,29,32)