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

Systemtic Name: methyl 4-(4-aminocarbonyl-1-butyl-5-methyl-2-pentyl-pyrrol-3-yl)benzoate Openeye Name: methyl 4-(1-butyl-4-carbamoyl-5-methyl-2-pentyl-pyrrol-3-yl)benzoate CAS Name: 4-(1-butyl-4-carbamoyl-5-methyl-2-pentyl-3-pyrrolyl)benzoic acid methyl ester IUPAC Name: methyl 4-(1-butyl-4-carbamoyl-5-methyl-2-pentylpyrrol-3-yl)benzoate Traditional Name: 4-(2-amyl-1-butyl-4-carbamoyl-5-methyl-pyrrol-3-yl)benzoic acid methyl ester Formula: C23H32N2O3 MolecularWeight: 384.51178

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(C(=C(N1CCCC)C)C(=O)N)C2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

CCCCCC1=C(C(=C(N1CCCC)C)C(=O)N)C2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C23H32N2O3/c1-5-7-9-10-19-21(17-11-13-18(14-12-17)23(27)28-4)20(22(24)26)16(3)25(19)15-8-6-2/h11-14H,5-10,15H2,1-4H3,(H2,24,26)