[2-(4-fluoranyl-2-methyl-phenyl)piperazin-1-yl] N-[(3,5-dimethylphenyl)methyl]-N-methyl-carbamate

Systemtic Name: [2-(4-fluoranyl-2-methyl-phenyl)piperazin-1-yl] N-[(3,5-dimethylphenyl)methyl]-N-methyl-carbamate Openeye Name: [2-(4-fluoro-2-methyl-phenyl)piperazin-1-yl] N-[(3,5-dimethylphenyl)methyl]-N-methyl-carbamate CAS Name: N-[(3,5-dimethylphenyl)methyl]-N-methylcarbamic acid [2-(4-fluoro-2-methylphenyl)-1-piperazinyl] ester IUPAC Name: [2-(4-fluoro-2-methylphenyl)piperazin-1-yl] N-[(3,5-dimethylphenyl)methyl]-N-methylcarbamate Traditional Name: N-(3,5-dimethylbenzyl)-N-methyl-carbamic acid [2-(4-fluoro-2-methyl-phenyl)piperazino] ester Formula: C22H28FN3O2 MolecularWeight: 385.475023

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)CN(C)C(=O)ON2CCNCC2C3=C(C=C(C=C3)F)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)CN(C)C(=O)ON2CCNCC2C3=C(C=C(C=C3)F)C)C

InChI

InChI=1S/C22H28FN3O2/c1-15-9-16(2)11-18(10-15)14-25(4)22(27)28-26-8-7-24-13-21(26)20-6-5-19(23)12-17(20)3/h5-6,9-12,21,24H,7-8,13-14H2,1-4H3