methyl 2-[[(1-ethanoylpyrrolidin-2-yl)carbonylamino]-(phenylcarbonyl)amino]-3-(1H-indol-3-yl)propanoate

Systemtic Name: methyl 2-[[(1-ethanoylpyrrolidin-2-yl)carbonylamino]-(phenylcarbonyl)amino]-3-(1H-indol-3-yl)propanoate Openeye Name: methyl 2-[[(1-acetylpyrrolidine-2-carbonyl)amino]-benzoyl-amino]-3-(1H-indol-3-yl)propanoate CAS Name: 2-[[[(1-acetyl-2-pyrrolidinyl)-oxomethyl]amino]-benzoylamino]-3-(1H-indol-3-yl)propanoic acid methyl ester IUPAC Name: methyl 2-[[(1-acetylpyrrolidine-2-carbonyl)amino]-benzoylamino]-3-(1H-indol-3-yl)propanoate Traditional Name: 2-[[(1-acetylprolyl)amino]-benzoyl-amino]-3-(1H-indol-3-yl)propionic acid methyl ester Formula: C26H28N4O5 MolecularWeight: 476.52432

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCCC1C(=O)NN(C(CC2=CNC3=CC=CC=C32)C(=O)OC)C(=O)C4=CC=CC=C4

Isomeric SMILES

CC(=O)N1CCCC1C(=O)NN(C(CC2=CNC3=CC=CC=C32)C(=O)OC)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C26H28N4O5/c1-17(31)29-14-8-13-22(29)24(32)28-30(25(33)18-9-4-3-5-10-18)23(26(34)35-2)15-19-16-27-21-12-7-6-11-20(19)21/h3-7,9-12,16,22-23,27H,8,13-15H2,1-2H3,(H,28,32)