methyl 2-[[3-(1H-indol-3-yl)-2-(phenylmethoxycarbonylamino)propanoyl]amino]-4-methyl-pentanoate

Systemtic Name: methyl 2-[[3-(1H-indol-3-yl)-2-(phenylmethoxycarbonylamino)propanoyl]amino]-4-methyl-pentanoate Openeye Name: methyl 2-[[2-(benzyloxycarbonylamino)-3-(1H-indol-3-yl)propanoyl]amino]-4-methyl-pentanoate CAS Name: 2-[[3-(1H-indol-3-yl)-1-oxo-2-(phenylmethoxycarbonylamino)propyl]amino]-4-methylpentanoic acid methyl ester IUPAC Name: methyl 2-[[3-(1H-indol-3-yl)-2-(phenylmethoxycarbonylamino)propanoyl]amino]-4-methylpentanoate Traditional Name: 2-[[2-(benzyloxycarbonylamino)-3-(1H-indol-3-yl)propanoyl]amino]-4-methyl-valeric acid methyl ester Formula: C26H31N3O5 MolecularWeight: 465.54144

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H31N3O5/c1-17(2)13-23(25(31)33-3)28-24(30)22(14-19-15-27-21-12-8-7-11-20(19)21)29-26(32)34-16-18-9-5-4-6-10-18/h4-12,15,17,22-23,27H,13-14,16H2,1-3H3,(H,28,30)(H,29,32)