8-(azepan-1-ylmethyl)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-oxidanyl-5,6,8,8a-tetrahydrochromen-7-one

Systemtic Name: 8-(azepan-1-ylmethyl)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-oxidanyl-5,6,8,8a-tetrahydrochromen-7-one Openeye Name: 8-(azepan-1-ylmethyl)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-hydroxy-5,6,8,8a-tetrahydrochromen-7-one CAS Name: 8-(1-azepanylmethyl)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-hydroxy-5,6,8,8a-tetrahydro-1-benzopyran-7-one IUPAC Name: 8-(azepan-1-ylmethyl)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-hydroxy-5,6,8,8a-tetrahydrochromen-7-one Traditional Name: 8-(azepan-1-ylmethyl)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-hydroxy-5,6,8,8a-tetrahydrochromen-7-one Formula: C24H29NO5 MolecularWeight: 411.49076

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CC2C3C(=C(C(=CO3)C4=CC5=C(C=C4)OCCO5)O)CCC2=O

Isomeric SMILES

C1CCCN(CC1)CC2C3C(=C(C(=CO3)C4=CC5=C(C=C4)OCCO5)O)CCC2=O

InChI

InChI=1S/C24H29NO5/c26-20-7-6-17-23(27)19(16-5-8-21-22(13-16)29-12-11-28-21)15-30-24(17)18(20)14-25-9-3-1-2-4-10-25/h5,8,13,15,18,24,27H,1-4,6-7,9-12,14H2