[3-(dimethylamino)-1-phenyl-propyl] 4-chloranylbenzoate chloride

Systemtic Name: [3-(dimethylamino)-1-phenyl-propyl] 4-chloranylbenzoate chloride Openeye Name: [3-(dimethylamino)-1-phenyl-propyl] 4-chlorobenzoate chloride CAS Name: 4-chlorobenzoic acid [3-(dimethylamino)-1-phenylpropyl] ester chloride IUPAC Name: [3-(dimethylamino)-1-phenylpropyl] 4-chlorobenzoate chloride Traditional Name: 4-chlorobenzoic acid [3-(dimethylamino)-1-phenyl-propyl] ester chloride Formula: C18H20Cl2NO2- MolecularWeight: 353.2629

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCC(C1=CC=CC=C1)OC(=O)C2=CC=C(C=C2)Cl.[Cl-]

Isomeric SMILES

CN(C)CCC(C1=CC=CC=C1)OC(=O)C2=CC=C(C=C2)Cl.[Cl-]

InChI

InChI=1S/C18H20ClNO2.ClH/c1-20(2)13-12-17(14-6-4-3-5-7-14)22-18(21)15-8-10-16(19)11-9-15;/h3-11,17H,12-13H2,1-2H3;1H/p-1