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

Systemtic Name: 8-(azepan-1-ylmethyl)-3-(1,3-benzodioxol-5-yl)-7-oxidanyl-chromen-2-one Openeye Name: 8-(azepan-1-ylmethyl)-3-(1,3-benzodioxol-5-yl)-7-hydroxy-chromen-2-one CAS Name: 8-(1-azepanylmethyl)-3-(1,3-benzodioxol-5-yl)-7-hydroxy-1-benzopyran-2-one IUPAC Name: 8-(azepan-1-ylmethyl)-3-(1,3-benzodioxol-5-yl)-7-hydroxychromen-2-one Traditional Name: 8-(azepan-1-ylmethyl)-3-(1,3-benzodioxol-5-yl)-7-hydroxy-coumarin Formula: C23H23NO5 MolecularWeight: 393.43242

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CC2=C(C=CC3=C2OC(=O)C(=C3)C4=CC5=C(C=C4)OCO5)O

Isomeric SMILES

C1CCCN(CC1)CC2=C(C=CC3=C2OC(=O)C(=C3)C4=CC5=C(C=C4)OCO5)O

InChI

InChI=1S/C23H23NO5/c25-19-7-5-16-11-17(15-6-8-20-21(12-15)28-14-27-20)23(26)29-22(16)18(19)13-24-9-3-1-2-4-10-24/h5-8,11-12,25H,1-4,9-10,13-14H2