8-[1-(1,3-benzodioxol-5-yl)-3-(3-methylpiperidin-1-yl)-3-oxidanylidene-propyl]-5,7-dimethoxy-chromen-2-one

Systemtic Name: 8-[1-(1,3-benzodioxol-5-yl)-3-(3-methylpiperidin-1-yl)-3-oxidanylidene-propyl]-5,7-dimethoxy-chromen-2-one Openeye Name: 8-[1-(1,3-benzodioxol-5-yl)-3-(3-methyl-1-piperidyl)-3-oxo-propyl]-5,7-dimethoxy-chromen-2-one CAS Name: 8-[1-(1,3-benzodioxol-5-yl)-3-(3-methyl-1-piperidinyl)-3-oxopropyl]-5,7-dimethoxy-1-benzopyran-2-one IUPAC Name: 8-[1-(1,3-benzodioxol-5-yl)-3-(3-methylpiperidin-1-yl)-3-oxopropyl]-5,7-dimethoxychromen-2-one Traditional Name: 8-[1-(1,3-benzodioxol-5-yl)-3-keto-3-(3-methylpiperidino)propyl]-5,7-dimethoxy-coumarin Formula: C27H29NO7 MolecularWeight: 479.52166

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C(=O)CC(C2=CC3=C(C=C2)OCO3)C4=C(C=C(C5=C4OC(=O)C=C5)OC)OC

Isomeric SMILES

CC1CCCN(C1)C(=O)CC(C2=CC3=C(C=C2)OCO3)C4=C(C=C(C5=C4OC(=O)C=C5)OC)OC

InChI

InChI=1S/C27H29NO7/c1-16-5-4-10-28(14-16)24(29)12-19(17-6-8-20-22(11-17)34-15-33-20)26-23(32-3)13-21(31-2)18-7-9-25(30)35-27(18)26/h6-9,11,13,16,19H,4-5,10,12,14-15H2,1-3H3