methyl 5-[2-[4-[(2-methoxy-5-methyl-phenyl)methyl]piperazin-1-yl]ethanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 5-[2-[4-[(2-methoxy-5-methyl-phenyl)methyl]piperazin-1-yl]ethanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: methyl 5-[2-[4-[(2-methoxy-5-methyl-phenyl)methyl]piperazin-1-yl]acetyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 5-[2-[4-[(2-methoxy-5-methylphenyl)methyl]-1-piperazinyl]-1-oxoethyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 5-[2-[4-[(2-methoxy-5-methylphenyl)methyl]piperazin-1-yl]acetyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 5-[2-[4-(2-methoxy-5-methyl-benzyl)piperazino]acetyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid methyl ester Formula: C23H31N3O4 MolecularWeight: 413.50994

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)CN2CCN(CC2)CC(=O)C3=C(C(=C(N3)C)C(=O)OC)C

Isomeric SMILES

CC1=CC(=C(C=C1)OC)CN2CCN(CC2)CC(=O)C3=C(C(=C(N3)C)C(=O)OC)C

InChI

InChI=1S/C23H31N3O4/c1-15-6-7-20(29-4)18(12-15)13-25-8-10-26(11-9-25)14-19(27)22-16(2)21(17(3)24-22)23(28)30-5/h6-7,12,24H,8-11,13-14H2,1-5H3