(dipentylamino) 2-[1-methyl-5-(4-methylphenyl)carbonyl-pyrrol-2-yl]ethanoate

Systemtic Name: (dipentylamino) 2-[1-methyl-5-(4-methylphenyl)carbonyl-pyrrol-2-yl]ethanoate Openeye Name: (dipentylamino) 2-[1-methyl-5-(4-methylbenzoyl)pyrrol-2-yl]acetate CAS Name: 2-[1-methyl-5-[(4-methylphenyl)-oxomethyl]-2-pyrrolyl]acetic acid (dipentylamino) ester IUPAC Name: (dipentylamino) 2-[1-methyl-5-(4-methylbenzoyl)pyrrol-2-yl]acetate Traditional Name: 2-(1-methyl-5-p-toluoyl-pyrrol-2-yl)acetic acid (diamylamino) ester Formula: C25H36N2O3 MolecularWeight: 412.56494

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CCCCC)OC(=O)CC1=CC=C(N1C)C(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCCCCN(CCCCC)OC(=O)CC1=CC=C(N1C)C(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C25H36N2O3/c1-5-7-9-17-27(18-10-8-6-2)30-24(28)19-22-15-16-23(26(22)4)25(29)21-13-11-20(3)12-14-21/h11-16H,5-10,17-19H2,1-4H3