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

Systemtic Name: methyl 3-(1-methylindol-3-yl)-2-(phenylmethoxycarbonylamino)propanoate Openeye Name: methyl 2-(benzyloxycarbonylamino)-3-(1-methylindol-3-yl)propanoate CAS Name: 3-(1-methyl-3-indolyl)-2-(phenylmethoxycarbonylamino)propanoic acid methyl ester IUPAC Name: methyl 3-(1-methylindol-3-yl)-2-(phenylmethoxycarbonylamino)propanoate Traditional Name: 2-(benzyloxycarbonylamino)-3-(1-methylindol-3-yl)propionic acid methyl ester Formula: C21H22N2O4 MolecularWeight: 366.41038

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=CC=CC=C21)CC(C(=O)OC)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CN1C=C(C2=CC=CC=C21)CC(C(=O)OC)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C21H22N2O4/c1-23-13-16(17-10-6-7-11-19(17)23)12-18(20(24)26-2)22-21(25)27-14-15-8-4-3-5-9-15/h3-11,13,18H,12,14H2,1-2H3,(H,22,25)