3-(1,3-benzodioxol-5-yl)-8-[(3-methylpiperidin-1-yl)methyl]-7-oxidanyl-chromen-2-one

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-8-[(3-methylpiperidin-1-yl)methyl]-7-oxidanyl-chromen-2-one Openeye Name: 3-(1,3-benzodioxol-5-yl)-7-hydroxy-8-[(3-methyl-1-piperidyl)methyl]chromen-2-one CAS Name: 3-(1,3-benzodioxol-5-yl)-7-hydroxy-8-[(3-methyl-1-piperidinyl)methyl]-1-benzopyran-2-one IUPAC Name: 3-(1,3-benzodioxol-5-yl)-7-hydroxy-8-[(3-methylpiperidin-1-yl)methyl]chromen-2-one Traditional Name: 3-(1,3-benzodioxol-5-yl)-7-hydroxy-8-[(3-methylpiperidino)methyl]coumarin Formula: C23H23NO5 MolecularWeight: 393.43242

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)CC2=C(C=CC3=C2OC(=O)C(=C3)C4=CC5=C(C=C4)OCO5)O

Isomeric SMILES

CC1CCCN(C1)CC2=C(C=CC3=C2OC(=O)C(=C3)C4=CC5=C(C=C4)OCO5)O

InChI

InChI=1S/C23H23NO5/c1-14-3-2-8-24(11-14)12-18-19(25)6-4-16-9-17(23(26)29-22(16)18)15-5-7-20-21(10-15)28-13-27-20/h4-7,9-10,14,25H,2-3,8,11-13H2,1H3