butyl 4-[[2,5-dimethyl-1-(pyridin-2-ylmethyl)pyrrol-3-yl]carbonylamino]benzoate

Systemtic Name: butyl 4-[[2,5-dimethyl-1-(pyridin-2-ylmethyl)pyrrol-3-yl]carbonylamino]benzoate Openeye Name: butyl 4-[[2,5-dimethyl-1-(2-pyridylmethyl)pyrrole-3-carbonyl]amino]benzoate CAS Name: 4-[[[2,5-dimethyl-1-(2-pyridinylmethyl)-3-pyrrolyl]-oxomethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[[2,5-dimethyl-1-(pyridin-2-ylmethyl)pyrrole-3-carbonyl]amino]benzoate Traditional Name: 4-[[2,5-dimethyl-1-(2-pyridylmethyl)pyrrole-3-carbonyl]amino]benzoic acid butyl ester Formula: C24H27N3O3 MolecularWeight: 405.48948

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=C(N(C(=C2)C)CC3=CC=CC=N3)C

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=C(N(C(=C2)C)CC3=CC=CC=N3)C

InChI

InChI=1S/C24H27N3O3/c1-4-5-14-30-24(29)19-9-11-20(12-10-19)26-23(28)22-15-17(2)27(18(22)3)16-21-8-6-7-13-25-21/h6-13,15H,4-5,14,16H2,1-3H3,(H,26,28)