8-(azepan-1-ylmethyl)-4-(8-ethoxy-2-oxidanylidene-chromen-3-yl)-7-oxidanyl-chromen-2-one

Systemtic Name: 8-(azepan-1-ylmethyl)-4-(8-ethoxy-2-oxidanylidene-chromen-3-yl)-7-oxidanyl-chromen-2-one Openeye Name: 8-(azepan-1-ylmethyl)-4-(8-ethoxy-2-oxo-chromen-3-yl)-7-hydroxy-chromen-2-one CAS Name: 8-(1-azepanylmethyl)-4-(8-ethoxy-2-oxo-1-benzopyran-3-yl)-7-hydroxy-1-benzopyran-2-one IUPAC Name: 8-(azepan-1-ylmethyl)-4-(8-ethoxy-2-oxochromen-3-yl)-7-hydroxychromen-2-one Traditional Name: 8-(azepan-1-ylmethyl)-4-(8-ethoxy-2-keto-chromen-3-yl)-7-hydroxy-coumarin Formula: C27H27NO6 MolecularWeight: 461.50638

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC2=C1OC(=O)C(=C2)C3=CC(=O)OC4=C3C=CC(=C4CN5CCCCCC5)O

Isomeric SMILES

CCOC1=CC=CC2=C1OC(=O)C(=C2)C3=CC(=O)OC4=C3C=CC(=C4CN5CCCCCC5)O

InChI

InChI=1S/C27H27NO6/c1-2-32-23-9-7-8-17-14-20(27(31)34-25(17)23)19-15-24(30)33-26-18(19)10-11-22(29)21(26)16-28-12-5-3-4-6-13-28/h7-11,14-15,29H,2-6,12-13,16H2,1H3