2-[(3-methoxyphenyl)methyl]-3-(2,5,5-trimethyl-4-prop-2-enyl-piperazin-1-yl)benzamide

Systemtic Name: 2-[(3-methoxyphenyl)methyl]-3-(2,5,5-trimethyl-4-prop-2-enyl-piperazin-1-yl)benzamide Openeye Name: 3-(4-allyl-2,5,5-trimethyl-piperazin-1-yl)-2-[(3-methoxyphenyl)methyl]benzamide CAS Name: 2-[(3-methoxyphenyl)methyl]-3-(2,5,5-trimethyl-4-prop-2-enyl-1-piperazinyl)benzamide IUPAC Name: 2-[(3-methoxyphenyl)methyl]-3-(2,5,5-trimethyl-4-prop-2-enylpiperazin-1-yl)benzamide Traditional Name: 3-(4-allyl-2,5,5-trimethyl-piperazino)-2-m-anisyl-benzamide Formula: C25H33N3O2 MolecularWeight: 407.54842

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CN(C(CN1C2=CC=CC(=C2CC3=CC(=CC=C3)OC)C(=O)N)(C)C)CC=C

Isomeric SMILES

CC1CN(C(CN1C2=CC=CC(=C2CC3=CC(=CC=C3)OC)C(=O)N)(C)C)CC=C

InChI

InChI=1S/C25H33N3O2/c1-6-13-27-16-18(2)28(17-25(27,3)4)23-12-8-11-21(24(26)29)22(23)15-19-9-7-10-20(14-19)30-5/h6-12,14,18H,1,13,15-17H2,2-5H3,(H2,26,29)