methyl 3-(1-methylindol-3-yl)-2-(phenylmethoxycarbonylamino)butanoate

Systemtic Name: methyl 3-(1-methylindol-3-yl)-2-(phenylmethoxycarbonylamino)butanoate Openeye Name: methyl 2-(benzyloxycarbonylamino)-3-(1-methylindol-3-yl)butanoate CAS Name: 3-(1-methyl-3-indolyl)-2-(phenylmethoxycarbonylamino)butanoic acid methyl ester IUPAC Name: methyl 3-(1-methylindol-3-yl)-2-(phenylmethoxycarbonylamino)butanoate Traditional Name: 2-(benzyloxycarbonylamino)-3-(1-methylindol-3-yl)butyric acid methyl ester Formula: C22H24N2O4 MolecularWeight: 380.43696

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CN(C2=CC=CC=C21)C)C(C(=O)OC)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC(C1=CN(C2=CC=CC=C21)C)C(C(=O)OC)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C22H24N2O4/c1-15(18-13-24(2)19-12-8-7-11-17(18)19)20(21(25)27-3)23-22(26)28-14-16-9-5-4-6-10-16/h4-13,15,20H,14H2,1-3H3,(H,23,26)