8-(azepan-1-ylmethyl)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-7-oxidanyl-chromen-2-one

Systemtic Name: 8-(azepan-1-ylmethyl)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-7-oxidanyl-chromen-2-one Openeye Name: 8-(azepan-1-ylmethyl)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-7-hydroxy-chromen-2-one CAS Name: 8-(1-azepanylmethyl)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-7-hydroxy-1-benzopyran-2-one IUPAC Name: 8-(azepan-1-ylmethyl)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-7-hydroxychromen-2-one Traditional Name: 8-(azepan-1-ylmethyl)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-7-hydroxy-coumarin Formula: C24H25NO5 MolecularWeight: 407.459

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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)OCCO5)O

Isomeric SMILES

C1CCCN(CC1)CC2=C(C=CC3=C2OC(=O)C(=C3)C4=CC5=C(C=C4)OCCO5)O

InChI

InChI=1S/C24H25NO5/c26-20-7-5-17-13-18(16-6-8-21-22(14-16)29-12-11-28-21)24(27)30-23(17)19(20)15-25-9-3-1-2-4-10-25/h5-8,13-14,26H,1-4,9-12,15H2