methyl 4-[4-aminocarbonyl-2-butyl-5-methyl-1-(pyridin-2-ylmethyl)pyrrol-3-yl]benzoate

Systemtic Name: methyl 4-[4-aminocarbonyl-2-butyl-5-methyl-1-(pyridin-2-ylmethyl)pyrrol-3-yl]benzoate Openeye Name: methyl 4-[2-butyl-4-carbamoyl-5-methyl-1-(2-pyridylmethyl)pyrrol-3-yl]benzoate CAS Name: 4-[2-butyl-4-carbamoyl-5-methyl-1-(2-pyridinylmethyl)-3-pyrrolyl]benzoic acid methyl ester IUPAC Name: methyl 4-[2-butyl-4-carbamoyl-5-methyl-1-(pyridin-2-ylmethyl)pyrrol-3-yl]benzoate Traditional Name: 4-[2-butyl-4-carbamoyl-5-methyl-1-(2-pyridylmethyl)pyrrol-3-yl]benzoic acid methyl ester Formula: C24H27N3O3 MolecularWeight: 405.48948

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(=C(N1CC2=CC=CC=N2)C)C(=O)N)C3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CCCCC1=C(C(=C(N1CC2=CC=CC=N2)C)C(=O)N)C3=CC=C(C=C3)C(=O)OC

InChI

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