methyl 3-[2-(1H-indol-3-yl)ethanoylamino]-2-(phenylmethoxycarbonylamino)propanoate

Systemtic Name: methyl 3-[2-(1H-indol-3-yl)ethanoylamino]-2-(phenylmethoxycarbonylamino)propanoate Openeye Name: methyl 2-(benzyloxycarbonylamino)-3-[[2-(1H-indol-3-yl)acetyl]amino]propanoate CAS Name: 3-[[2-(1H-indol-3-yl)-1-oxoethyl]amino]-2-(phenylmethoxycarbonylamino)propanoic acid methyl ester IUPAC Name: methyl 3-[[2-(1H-indol-3-yl)acetyl]amino]-2-(phenylmethoxycarbonylamino)propanoate Traditional Name: 2-(benzyloxycarbonylamino)-3-[[2-(1H-indol-3-yl)acetyl]amino]propionic acid methyl ester Formula: C22H23N3O5 MolecularWeight: 409.43512

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CNC(=O)CC1=CNC2=CC=CC=C21)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

COC(=O)C(CNC(=O)CC1=CNC2=CC=CC=C21)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C22H23N3O5/c1-29-21(27)19(25-22(28)30-14-15-7-3-2-4-8-15)13-24-20(26)11-16-12-23-18-10-6-5-9-17(16)18/h2-10,12,19,23H,11,13-14H2,1H3,(H,24,26)(H,25,28)