methyl 3-[[2,5-dimethyl-1-(pyridin-2-ylmethyl)pyrrol-3-yl]carbonylamino]-3-phenyl-propanoate

Systemtic Name: methyl 3-[[2,5-dimethyl-1-(pyridin-2-ylmethyl)pyrrol-3-yl]carbonylamino]-3-phenyl-propanoate Openeye Name: methyl 3-[[2,5-dimethyl-1-(2-pyridylmethyl)pyrrole-3-carbonyl]amino]-3-phenyl-propanoate CAS Name: 3-[[[2,5-dimethyl-1-(2-pyridinylmethyl)-3-pyrrolyl]-oxomethyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl 3-[[2,5-dimethyl-1-(pyridin-2-ylmethyl)pyrrole-3-carbonyl]amino]-3-phenylpropanoate Traditional Name: 3-[[2,5-dimethyl-1-(2-pyridylmethyl)pyrrole-3-carbonyl]amino]-3-phenyl-propionic acid methyl ester Formula: C23H25N3O3 MolecularWeight: 391.4629

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CC2=CC=CC=N2)C)C(=O)NC(CC(=O)OC)C3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(N1CC2=CC=CC=N2)C)C(=O)NC(CC(=O)OC)C3=CC=CC=C3

InChI

InChI=1S/C23H25N3O3/c1-16-13-20(17(2)26(16)15-19-11-7-8-12-24-19)23(28)25-21(14-22(27)29-3)18-9-5-4-6-10-18/h4-13,21H,14-15H2,1-3H3,(H,25,28)