(phenylmethyl) 3-(1H-indol-3-yl)-2-[[2-methyl-3-(3H-pyrrol-5-yl)propanoyl]amino]propanoate

Systemtic Name: (phenylmethyl) 3-(1H-indol-3-yl)-2-[[2-methyl-3-(3H-pyrrol-5-yl)propanoyl]amino]propanoate Openeye Name: benzyl 3-(1H-indol-3-yl)-2-[[2-methyl-3-(3H-pyrrol-5-yl)propanoyl]amino]propanoate CAS Name: 3-(1H-indol-3-yl)-2-[[2-methyl-1-oxo-3-(3H-pyrrol-5-yl)propyl]amino]propanoic acid (phenylmethyl) ester IUPAC Name: benzyl 3-(1H-indol-3-yl)-2-[[2-methyl-3-(3H-pyrrol-5-yl)propanoyl]amino]propanoate Traditional Name: 3-(1H-indol-3-yl)-2-[[2-methyl-3-(3H-pyrrol-5-yl)propanoyl]amino]propionic acid benzyl ester Formula: C26H27N3O3 MolecularWeight: 429.51088

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CCC=N1)C(=O)NC(CC2=CNC3=CC=CC=C32)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

CC(CC1=CCC=N1)C(=O)NC(CC2=CNC3=CC=CC=C32)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C26H27N3O3/c1-18(14-21-10-7-13-27-21)25(30)29-24(26(31)32-17-19-8-3-2-4-9-19)15-20-16-28-23-12-6-5-11-22(20)23/h2-6,8-13,16,18,24,28H,7,14-15,17H2,1H3,(H,29,30)