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

Systemtic Name: 8-[1-(1,3-benzodioxol-5-yl)-3-piperidin-1-yl-propyl]-5,7-dimethoxy-4-pentyl-chromen-2-one Openeye Name: 8-[1-(1,3-benzodioxol-5-yl)-3-(1-piperidyl)propyl]-5,7-dimethoxy-4-pentyl-chromen-2-one CAS Name: 8-[1-(1,3-benzodioxol-5-yl)-3-(1-piperidinyl)propyl]-5,7-dimethoxy-4-pentyl-1-benzopyran-2-one IUPAC Name: 8-[1-(1,3-benzodioxol-5-yl)-3-piperidin-1-ylpropyl]-5,7-dimethoxy-4-pentylchromen-2-one Traditional Name: 4-amyl-8-[1-(1,3-benzodioxol-5-yl)-3-piperidino-propyl]-5,7-dimethoxy-coumarin Formula: C31H39NO6 MolecularWeight: 521.64446

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC(=O)OC2=C1C(=CC(=C2C(CCN3CCCCC3)C4=CC5=C(C=C4)OCO5)OC)OC

Isomeric SMILES

CCCCCC1=CC(=O)OC2=C1C(=CC(=C2C(CCN3CCCCC3)C4=CC5=C(C=C4)OCO5)OC)OC

InChI

InChI=1S/C31H39NO6/c1-4-5-7-10-22-18-28(33)38-31-29(22)26(34-2)19-27(35-3)30(31)23(13-16-32-14-8-6-9-15-32)21-11-12-24-25(17-21)37-20-36-24/h11-12,17-19,23H,4-10,13-16,20H2,1-3H3