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

Systemtic Name: methyl 3-(1H-indol-3-yl)-2-[2-[methyl(phenylmethoxycarbonylamino)amino]ethanoylamino]propanoate Openeye Name: methyl 2-[[2-[benzyloxycarbonylamino(methyl)amino]acetyl]amino]-3-(1H-indol-3-yl)propanoate CAS Name: 3-(1H-indol-3-yl)-2-[[2-[methyl(phenylmethoxycarbonylamino)amino]-1-oxoethyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-(1H-indol-3-yl)-2-[[2-[methyl(phenylmethoxycarbonylamino)amino]acetyl]amino]propanoate Traditional Name: 2-[[2-[benzyloxycarbonylamino(methyl)amino]acetyl]amino]-3-(1H-indol-3-yl)propionic acid methyl ester Formula: C23H26N4O5 MolecularWeight: 438.47634

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)OC)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CN(CC(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)OC)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C23H26N4O5/c1-27(26-23(30)32-15-16-8-4-3-5-9-16)14-21(28)25-20(22(29)31-2)12-17-13-24-19-11-7-6-10-18(17)19/h3-11,13,20,24H,12,14-15H2,1-2H3,(H,25,28)(H,26,30)