[2-(dimethylaminomethyl)cyclohexyl] 4-chloranylbenzoate chloride

Systemtic Name: [2-(dimethylaminomethyl)cyclohexyl] 4-chloranylbenzoate chloride Openeye Name: [2-(dimethylaminomethyl)cyclohexyl] 4-chlorobenzoate chloride CAS Name: 4-chlorobenzoic acid [2-(dimethylaminomethyl)cyclohexyl] ester chloride IUPAC Name: [2-(dimethylaminomethyl)cyclohexyl] 4-chlorobenzoate chloride Traditional Name: 4-chlorobenzoic acid [2-(dimethylaminomethyl)cyclohexyl] ester chloride Formula: C16H22Cl2NO2- MolecularWeight: 331.25738

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1CCCCC1OC(=O)C2=CC=C(C=C2)Cl.[Cl-]

Isomeric SMILES

CN(C)CC1CCCCC1OC(=O)C2=CC=C(C=C2)Cl.[Cl-]

InChI

InChI=1S/C16H22ClNO2.ClH/c1-18(2)11-13-5-3-4-6-15(13)20-16(19)12-7-9-14(17)10-8-12;/h7-10,13,15H,3-6,11H2,1-2H3;1H/p-1