2-[4-[(3,4-dimethoxyphenyl)methyl]piperazin-1-yl]-1-(2,5-dimethyl-1-propan-2-yl-pyrrol-3-yl)ethanone

Systemtic Name: 2-[4-[(3,4-dimethoxyphenyl)methyl]piperazin-1-yl]-1-(2,5-dimethyl-1-propan-2-yl-pyrrol-3-yl)ethanone Openeye Name: 2-[4-[(3,4-dimethoxyphenyl)methyl]piperazin-1-yl]-1-(1-isopropyl-2,5-dimethyl-pyrrol-3-yl)ethanone CAS Name: 2-[4-[(3,4-dimethoxyphenyl)methyl]-1-piperazinyl]-1-(2,5-dimethyl-1-propan-2-yl-3-pyrrolyl)ethanone IUPAC Name: 2-[4-[(3,4-dimethoxyphenyl)methyl]piperazin-1-yl]-1-(2,5-dimethyl-1-propan-2-ylpyrrol-3-yl)ethanone Traditional Name: 1-(1-isopropyl-2,5-dimethyl-pyrrol-3-yl)-2-(4-veratrylpiperazino)ethanone Formula: C24H35N3O3 MolecularWeight: 413.553

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C(C)C)C)C(=O)CN2CCN(CC2)CC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC1=CC(=C(N1C(C)C)C)C(=O)CN2CCN(CC2)CC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C24H35N3O3/c1-17(2)27-18(3)13-21(19(27)4)22(28)16-26-11-9-25(10-12-26)15-20-7-8-23(29-5)24(14-20)30-6/h7-8,13-14,17H,9-12,15-16H2,1-6H3