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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(C(CN1C2=C(C=CC=C2OC)CC3=CC=CC(=C3)C(=O)N(C)C4=CC(=CC=C4)F)C)CC=C

Isomeric SMILES

CC1CN(C(CN1C2=C(C=CC=C2OC)CC3=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(30)37-5)17-24-10-7-12-26(18-24)31(36)33(4)28-14-9-13-27(32)19-28/h6-15,18-19,22-23H,1,16-17,20-21H2,2-5H3