12-(1,3-benzodioxol-5-yl)-9,9-dimethyl-8,10-dihydrobenzo[b][4,7]phenanthrolin-11-one

Systemtic Name: 12-(1,3-benzodioxol-5-yl)-9,9-dimethyl-8,10-dihydrobenzo[b][4,7]phenanthrolin-11-one Openeye Name: 12-(1,3-benzodioxol-5-yl)-9,9-dimethyl-8,10-dihydrobenzo[b][4,7]phenanthrolin-11-one CAS Name: 12-(1,3-benzodioxol-5-yl)-9,9-dimethyl-8,10-dihydrobenzo[b][4,7]phenanthrolin-11-one IUPAC Name: 12-(1,3-benzodioxol-5-yl)-9,9-dimethyl-8,10-dihydrobenzo[b][4,7]phenanthrolin-11-one Traditional Name: 12-(1,3-benzodioxol-5-yl)-9,9-dimethyl-8,10-dihydrobenzo[b][4,7]phenanthrolin-11-one Formula: C25H20N2O3 MolecularWeight: 396.4379

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(=O)C1)C(=C3C4=C(C=CC3=N2)N=CC=C4)C5=CC6=C(C=C5)OCO6)C

Isomeric SMILES

CC1(CC2=C(C(=O)C1)C(=C3C4=C(C=CC3=N2)N=CC=C4)C5=CC6=C(C=C5)OCO6)C

InChI

InChI=1S/C25H20N2O3/c1-25(2)11-18-24(19(28)12-25)22(14-5-8-20-21(10-14)30-13-29-20)23-15-4-3-9-26-16(15)6-7-17(23)27-18/h3-10H,11-13H2,1-2H3