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

Systemtic Name: 3-[(2,5-dimethyl-4-prop-2-enyl-piperazin-1-yl)-(3-methoxyphenyl)methyl]-N-(3-fluorophenyl)-N-methyl-benzamide Openeye Name: 3-[(4-allyl-2,5-dimethyl-piperazin-1-yl)-(3-methoxyphenyl)methyl]-N-(3-fluorophenyl)-N-methyl-benzamide CAS Name: 3-[(2,5-dimethyl-4-prop-2-enyl-1-piperazinyl)-(3-methoxyphenyl)methyl]-N-(3-fluorophenyl)-N-methylbenzamide IUPAC Name: 3-[(2,5-dimethyl-4-prop-2-enylpiperazin-1-yl)-(3-methoxyphenyl)methyl]-N-(3-fluorophenyl)-N-methylbenzamide Traditional Name: 3-[(4-allyl-2,5-dimethyl-piperazino)-(3-methoxyphenyl)methyl]-N-(3-fluorophenyl)-N-methyl-benzamide Formula: C31H36FN3O2 MolecularWeight: 501.634843

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(C(CN1C(C2=CC(=CC=C2)OC)C3=CC=CC(=C3)C(=O)N(C)C4=CC(=CC=C4)F)C)CC=C

Isomeric SMILES

CC1CN(C(CN1C(C2=CC(=CC=C2)OC)C3=CC=CC(=C3)C(=O)N(C)C4=CC(=CC=C4)F)C)CC=C

InChI

InChI=1S/C31H36FN3O2/c1-6-16-34-20-23(3)35(21-22(34)2)30(25-11-8-15-29(18-25)37-5)24-10-7-12-26(17-24)31(36)33(4)28-14-9-13-27(32)19-28/h6-15,17-19,22-23,30H,1,16,20-21H2,2-5H3