1,2,3-trimethoxy-10-oxidanyl-7-[(phenylmethylidene)amino]-6,7-dihydro-5H-benzo[a]heptalen-9-one

Systemtic Name: 1,2,3-trimethoxy-10-oxidanyl-7-[(phenylmethylidene)amino]-6,7-dihydro-5H-benzo[a]heptalen-9-one Openeye Name: 7-(benzylideneamino)-10-hydroxy-1,2,3-trimethoxy-6,7-dihydro-5H-benzo[a]heptalen-9-one CAS Name: 10-hydroxy-1,2,3-trimethoxy-7-[(phenylmethylene)amino]-6,7-dihydro-5H-benzo[a]heptalen-9-one IUPAC Name: 7-(benzylideneamino)-10-hydroxy-1,2,3-trimethoxy-6,7-dihydro-5H-benzo[a]heptalen-9-one Traditional Name: 7-(benzalamino)-10-hydroxy-1,2,3-trimethoxy-6,7-dihydro-5H-benzo[a]heptalen-9-one Formula: C26H25NO5 MolecularWeight: 431.4804

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C2C(=C1)CCC(C3=CC(=O)C(=CC=C32)O)N=CC4=CC=CC=C4)OC)OC

Isomeric SMILES

COC1=C(C(=C2C(=C1)CCC(C3=CC(=O)C(=CC=C32)O)N=CC4=CC=CC=C4)OC)OC

InChI

InChI=1S/C26H25NO5/c1-30-23-13-17-9-11-20(27-15-16-7-5-4-6-8-16)19-14-22(29)21(28)12-10-18(19)24(17)26(32-3)25(23)31-2/h4-8,10,12-15,20H,9,11H2,1-3H3,(H,28,29)