5,7-dimethoxy-8-[(1R)-3-piperidin-1-yl-1-(3,4,5-trimethoxyphenyl)propyl]chromen-2-one

Systemtic Name: 5,7-dimethoxy-8-[(1R)-3-piperidin-1-yl-1-(3,4,5-trimethoxyphenyl)propyl]chromen-2-one Openeye Name: 5,7-dimethoxy-8-[(1R)-3-(1-piperidyl)-1-(3,4,5-trimethoxyphenyl)propyl]chromen-2-one CAS Name: 5,7-dimethoxy-8-[(1R)-3-(1-piperidinyl)-1-(3,4,5-trimethoxyphenyl)propyl]-1-benzopyran-2-one IUPAC Name: 5,7-dimethoxy-8-[(1R)-3-piperidin-1-yl-1-(3,4,5-trimethoxyphenyl)propyl]chromen-2-one Traditional Name: 5,7-dimethoxy-8-[(1R)-3-piperidino-1-(3,4,5-trimethoxyphenyl)propyl]coumarin Formula: C28H35NO7 MolecularWeight: 497.58

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(CCN2CCCCC2)C3=C(C=C(C4=C3OC(=O)C=C4)OC)OC

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)[C@@H](CCN2CCCCC2)C3=C(C=C(C4=C3OC(=O)C=C4)OC)OC

InChI

InChI=1S/C28H35NO7/c1-31-21-17-22(32-2)26(27-20(21)9-10-25(30)36-27)19(11-14-29-12-7-6-8-13-29)18-15-23(33-3)28(35-5)24(16-18)34-4/h9-10,15-17,19H,6-8,11-14H2,1-5H3/t19-/m1/s1