methyl 4-(4-aminocarbonyl-2-butyl-1-cyclopropyl-5-methyl-pyrrol-3-yl)benzoate

Systemtic Name: methyl 4-(4-aminocarbonyl-2-butyl-1-cyclopropyl-5-methyl-pyrrol-3-yl)benzoate Openeye Name: methyl 4-(2-butyl-4-carbamoyl-1-cyclopropyl-5-methyl-pyrrol-3-yl)benzoate CAS Name: 4-(2-butyl-4-carbamoyl-1-cyclopropyl-5-methyl-3-pyrrolyl)benzoic acid methyl ester IUPAC Name: methyl 4-(2-butyl-4-carbamoyl-1-cyclopropyl-5-methylpyrrol-3-yl)benzoate Traditional Name: 4-(2-butyl-4-carbamoyl-1-cyclopropyl-5-methyl-pyrrol-3-yl)benzoic acid methyl ester Formula: C21H26N2O3 MolecularWeight: 354.44274

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(=C(N1C2CC2)C)C(=O)N)C3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CCCCC1=C(C(=C(N1C2CC2)C)C(=O)N)C3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C21H26N2O3/c1-4-5-6-17-19(14-7-9-15(10-8-14)21(25)26-3)18(20(22)24)13(2)23(17)16-11-12-16/h7-10,16H,4-6,11-12H2,1-3H3,(H2,22,24)