methyl 3-[(4-methoxy-1H-indol-2-yl)carbonylamino]-2-(phenylmethoxycarbonylamino)propanoate

Systemtic Name: methyl 3-[(4-methoxy-1H-indol-2-yl)carbonylamino]-2-(phenylmethoxycarbonylamino)propanoate Openeye Name: methyl 2-(benzyloxycarbonylamino)-3-[(4-methoxy-1H-indole-2-carbonyl)amino]propanoate CAS Name: 3-[[(4-methoxy-1H-indol-2-yl)-oxomethyl]amino]-2-(phenylmethoxycarbonylamino)propanoic acid methyl ester IUPAC Name: methyl 3-[(4-methoxy-1H-indole-2-carbonyl)amino]-2-(phenylmethoxycarbonylamino)propanoate Traditional Name: 2-(benzyloxycarbonylamino)-3-[(4-methoxy-1H-indole-2-carbonyl)amino]propionic acid methyl ester Formula: C22H23N3O6 MolecularWeight: 425.43452

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1C=C(N2)C(=O)NCC(C(=O)OC)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

COC1=CC=CC2=C1C=C(N2)C(=O)NCC(C(=O)OC)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C22H23N3O6/c1-29-19-10-6-9-16-15(19)11-17(24-16)20(26)23-12-18(21(27)30-2)25-22(28)31-13-14-7-4-3-5-8-14/h3-11,18,24H,12-13H2,1-2H3,(H,23,26)(H,25,28)