3,3-dimethyl-5-pyridin-3-yl-2,4,5,6-tetrahydrobenzo[a]phenanthridin-1-one

Systemtic Name: 3,3-dimethyl-5-pyridin-3-yl-2,4,5,6-tetrahydrobenzo[a]phenanthridin-1-one Openeye Name: 3,3-dimethyl-5-(3-pyridyl)-2,4,5,6-tetrahydrobenzo[a]phenanthridin-1-one CAS Name: 3,3-dimethyl-5-(3-pyridinyl)-2,4,5,6-tetrahydrobenzo[a]phenanthridin-1-one IUPAC Name: 3,3-dimethyl-5-pyridin-3-yl-2,4,5,6-tetrahydrobenzo[a]phenanthridin-1-one Traditional Name: 3,3-dimethyl-5-(3-pyridyl)-2,4,5,6-tetrahydrobenzo[a]phenanthridin-1-one Formula: C24H22N2O MolecularWeight: 354.44428

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(=O)C1)C3=C(C=CC4=CC=CC=C43)NC2C5=CN=CC=C5)C

Isomeric SMILES

CC1(CC2=C(C(=O)C1)C3=C(C=CC4=CC=CC=C43)NC2C5=CN=CC=C5)C

InChI

InChI=1S/C24H22N2O/c1-24(2)12-18-22(20(27)13-24)21-17-8-4-3-6-15(17)9-10-19(21)26-23(18)16-7-5-11-25-14-16/h3-11,14,23,26H,12-13H2,1-2H3