1-[(3S)-3-(chloromethyl)piperidin-1-yl]-3-(3,4-dimethoxyphenyl)propan-1-one

Systemtic Name: 1-[(3S)-3-(chloromethyl)piperidin-1-yl]-3-(3,4-dimethoxyphenyl)propan-1-one Openeye Name: 1-[(3S)-3-(chloromethyl)-1-piperidyl]-3-(3,4-dimethoxyphenyl)propan-1-one CAS Name: 1-[(3S)-3-(chloromethyl)-1-piperidinyl]-3-(3,4-dimethoxyphenyl)-1-propanone IUPAC Name: 1-[(3S)-3-(chloromethyl)piperidin-1-yl]-3-(3,4-dimethoxyphenyl)propan-1-one Traditional Name: 1-[(3S)-3-(chloromethyl)piperidino]-3-(3,4-dimethoxyphenyl)propan-1-one Formula: C17H24ClNO3 MolecularWeight: 325.83036

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCC(=O)N2CCCC(C2)CCl)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCC(=O)N2CCC[C@@H](C2)CCl)OC

InChI

InChI=1S/C17H24ClNO3/c1-21-15-7-5-13(10-16(15)22-2)6-8-17(20)19-9-3-4-14(11-18)12-19/h5,7,10,14H,3-4,6,8-9,11-12H2,1-2H3/t14-/m1/s1