1-[(3S)-3-(3,4-dimethoxyphenyl)carbonylpiperidin-1-yl]-3-(furan-2-yl)propan-1-one

Systemtic Name: 1-[(3S)-3-(3,4-dimethoxyphenyl)carbonylpiperidin-1-yl]-3-(furan-2-yl)propan-1-one Openeye Name: 1-[(3S)-3-(3,4-dimethoxybenzoyl)-1-piperidyl]-3-(2-furyl)propan-1-one CAS Name: 1-[(3S)-3-[(3,4-dimethoxyphenyl)-oxomethyl]-1-piperidinyl]-3-(2-furanyl)-1-propanone IUPAC Name: 1-[(3S)-3-(3,4-dimethoxybenzoyl)piperidin-1-yl]-3-(furan-2-yl)propan-1-one Traditional Name: 3-(2-furyl)-1-[(3S)-3-veratroylpiperidino]propan-1-one Formula: C21H25NO5 MolecularWeight: 371.4269

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)C2CCCN(C2)C(=O)CCC3=CC=CO3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)[C@H]2CCCN(C2)C(=O)CCC3=CC=CO3)OC

InChI

InChI=1S/C21H25NO5/c1-25-18-9-7-15(13-19(18)26-2)21(24)16-5-3-11-22(14-16)20(23)10-8-17-6-4-12-27-17/h4,6-7,9,12-13,16H,3,5,8,10-11,14H2,1-2H3/t16-/m0/s1