9,9-dimethyl-12-pyridin-2-yl-7,8,10,12-tetrahydrobenzo[b][4,7]phenanthrolin-4-ium-11-one

Systemtic Name: 9,9-dimethyl-12-pyridin-2-yl-7,8,10,12-tetrahydrobenzo[b][4,7]phenanthrolin-4-ium-11-one Openeye Name: 9,9-dimethyl-12-(2-pyridyl)-7,8,10,12-tetrahydrobenzo[b][4,7]phenanthrolin-4-ium-11-one CAS Name: 9,9-dimethyl-12-(2-pyridinyl)-7,8,10,12-tetrahydrobenzo[b][4,7]phenanthrolin-4-ium-11-one IUPAC Name: 9,9-dimethyl-12-pyridin-2-yl-7,8,10,12-tetrahydrobenzo[b][4,7]phenanthrolin-4-ium-11-one Traditional Name: 9,9-dimethyl-12-(2-pyridyl)-7,8,10,12-tetrahydrobenzo[b][4,7]phenanthrolin-4-ium-11-one Formula: C23H22N3O+ MolecularWeight: 356.44028

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(C3=C(N2)C=CC4=C3C=CC=[NH+]4)C5=CC=CC=N5)C(=O)C1)C

Isomeric SMILES

CC1(CC2=C(C(C3=C(N2)C=CC4=C3C=CC=[NH+]4)C5=CC=CC=N5)C(=O)C1)C

InChI

InChI=1S/C23H21N3O/c1-23(2)12-18-21(19(27)13-23)22(16-7-3-4-10-25-16)20-14-6-5-11-24-15(14)8-9-17(20)26-18/h3-11,22,26H,12-13H2,1-2H3/p+1