2,2-dimethyl-5-(4-methyl-3-nitro-phenyl)-1,3,5,6-tetrahydrobenzo[a]phenanthridin-4-one

Systemtic Name: 2,2-dimethyl-5-(4-methyl-3-nitro-phenyl)-1,3,5,6-tetrahydrobenzo[a]phenanthridin-4-one Openeye Name: 2,2-dimethyl-5-(4-methyl-3-nitro-phenyl)-1,3,5,6-tetrahydrobenzo[a]phenanthridin-4-one CAS Name: 2,2-dimethyl-5-(4-methyl-3-nitrophenyl)-1,3,5,6-tetrahydrobenzo[a]phenanthridin-4-one IUPAC Name: 2,2-dimethyl-5-(4-methyl-3-nitrophenyl)-1,3,5,6-tetrahydrobenzo[a]phenanthridin-4-one Traditional Name: 2,2-dimethyl-5-(4-methyl-3-nitro-phenyl)-1,3,5,6-tetrahydrobenzo[a]phenanthridin-4-one Formula: C26H24N2O3 MolecularWeight: 412.48036

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2C3=C(CC(CC3=O)(C)C)C4=C(N2)C=CC5=CC=CC=C54)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C2C3=C(CC(CC3=O)(C)C)C4=C(N2)C=CC5=CC=CC=C54)[N+](=O)[O-]

InChI

InChI=1S/C26H24N2O3/c1-15-8-9-17(12-21(15)28(30)31)25-24-19(13-26(2,3)14-22(24)29)23-18-7-5-4-6-16(18)10-11-20(23)27-25/h4-12,25,27H,13-14H2,1-3H3