[1-[(3-chloranyl-5-methoxy-4-oxidanyl-phenyl)methyl]piperidin-3-yl]-(3-chlorophenyl)methanone

Systemtic Name: [1-[(3-chloranyl-5-methoxy-4-oxidanyl-phenyl)methyl]piperidin-3-yl]-(3-chlorophenyl)methanone Openeye Name: [1-[(3-chloro-4-hydroxy-5-methoxy-phenyl)methyl]-3-piperidyl]-(3-chlorophenyl)methanone CAS Name: [1-[(3-chloro-4-hydroxy-5-methoxyphenyl)methyl]-3-piperidinyl]-(3-chlorophenyl)methanone IUPAC Name: [1-[(3-chloro-4-hydroxy-5-methoxyphenyl)methyl]piperidin-3-yl]-(3-chlorophenyl)methanone Traditional Name: [1-(3-chloro-4-hydroxy-5-methoxy-benzyl)-3-piperidyl]-(3-chlorophenyl)methanone Formula: C20H21Cl2NO3 MolecularWeight: 394.29164

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)CN2CCCC(C2)C(=O)C3=CC(=CC=C3)Cl)Cl)O

Isomeric SMILES

COC1=C(C(=CC(=C1)CN2CCCC(C2)C(=O)C3=CC(=CC=C3)Cl)Cl)O

InChI

InChI=1S/C20H21Cl2NO3/c1-26-18-9-13(8-17(22)20(18)25)11-23-7-3-5-15(12-23)19(24)14-4-2-6-16(21)10-14/h2,4,6,8-10,15,25H,3,5,7,11-12H2,1H3