3-(1,3-benzodioxol-5-yl)-4-methyl-7-oxidanyl-8-(piperidin-1-ylmethyl)chromen-2-one

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-4-methyl-7-oxidanyl-8-(piperidin-1-ylmethyl)chromen-2-one Openeye Name: 3-(1,3-benzodioxol-5-yl)-7-hydroxy-4-methyl-8-(1-piperidylmethyl)chromen-2-one CAS Name: 3-(1,3-benzodioxol-5-yl)-7-hydroxy-4-methyl-8-(1-piperidinylmethyl)-1-benzopyran-2-one IUPAC Name: 3-(1,3-benzodioxol-5-yl)-7-hydroxy-4-methyl-8-(piperidin-1-ylmethyl)chromen-2-one Traditional Name: 3-(1,3-benzodioxol-5-yl)-7-hydroxy-4-methyl-8-(piperidinomethyl)coumarin Formula: C23H23NO5 MolecularWeight: 393.43242

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2CN3CCCCC3)O)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2CN3CCCCC3)O)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C23H23NO5/c1-14-16-6-7-18(25)17(12-24-9-3-2-4-10-24)22(16)29-23(26)21(14)15-5-8-19-20(11-15)28-13-27-19/h5-8,11,25H,2-4,9-10,12-13H2,1H3