3-(2-methylphenyl)-1-(4-methylpiperazin-1-yl)-3-pyrrol-1-yl-propan-1-one

Systemtic Name: 3-(2-methylphenyl)-1-(4-methylpiperazin-1-yl)-3-pyrrol-1-yl-propan-1-one Openeye Name: 1-(4-methylpiperazin-1-yl)-3-(o-tolyl)-3-pyrrol-1-yl-propan-1-one CAS Name: 3-(2-methylphenyl)-1-(4-methyl-1-piperazinyl)-3-(1-pyrrolyl)-1-propanone IUPAC Name: 3-(2-methylphenyl)-1-(4-methylpiperazin-1-yl)-3-pyrrol-1-ylpropan-1-one Traditional Name: 1-(4-methylpiperazino)-3-(o-tolyl)-3-pyrrol-1-yl-propan-1-one Formula: C19H25N3O MolecularWeight: 311.4213

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(CC(=O)N2CCN(CC2)C)N3C=CC=C3

Isomeric SMILES

CC1=CC=CC=C1C(CC(=O)N2CCN(CC2)C)N3C=CC=C3

InChI

InChI=1S/C19H25N3O/c1-16-7-3-4-8-17(16)18(21-9-5-6-10-21)15-19(23)22-13-11-20(2)12-14-22/h3-10,18H,11-15H2,1-2H3