[(3S)-1-(cyclohexen-1-ylcarbonyl)piperidin-3-yl]-(3,4-dimethoxyphenyl)methanone

Systemtic Name: [(3S)-1-(cyclohexen-1-ylcarbonyl)piperidin-3-yl]-(3,4-dimethoxyphenyl)methanone Openeye Name: [(3S)-1-(cyclohexene-1-carbonyl)-3-piperidyl]-(3,4-dimethoxyphenyl)methanone CAS Name: [(3S)-1-[1-cyclohexenyl(oxo)methyl]-3-piperidinyl]-(3,4-dimethoxyphenyl)methanone IUPAC Name: [(3S)-1-(cyclohexene-1-carbonyl)piperidin-3-yl]-(3,4-dimethoxyphenyl)methanone Traditional Name: [(3S)-1-(cyclohexene-1-carbonyl)-3-piperidyl]-(3,4-dimethoxyphenyl)methanone Formula: C21H27NO4 MolecularWeight: 357.44338

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)C2CCCN(C2)C(=O)C3=CCCCC3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)[C@H]2CCCN(C2)C(=O)C3=CCCCC3)OC

InChI

InChI=1S/C21H27NO4/c1-25-18-11-10-16(13-19(18)26-2)20(23)17-9-6-12-22(14-17)21(24)15-7-4-3-5-8-15/h7,10-11,13,17H,3-6,8-9,12,14H2,1-2H3/t17-/m0/s1