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

Systemtic Name: 5-(5-methoxy-2-nitro-4-oxidanyl-phenyl)-2,2-dimethyl-1,3,5,6-tetrahydrobenzo[a]phenanthridin-4-one Openeye Name: 5-(4-hydroxy-5-methoxy-2-nitro-phenyl)-2,2-dimethyl-1,3,5,6-tetrahydrobenzo[a]phenanthridin-4-one CAS Name: 5-(4-hydroxy-5-methoxy-2-nitrophenyl)-2,2-dimethyl-1,3,5,6-tetrahydrobenzo[a]phenanthridin-4-one IUPAC Name: 5-(4-hydroxy-5-methoxy-2-nitrophenyl)-2,2-dimethyl-1,3,5,6-tetrahydrobenzo[a]phenanthridin-4-one Traditional Name: 5-(4-hydroxy-5-methoxy-2-nitro-phenyl)-2,2-dimethyl-1,3,5,6-tetrahydrobenzo[a]phenanthridin-4-one Formula: C26H24N2O5 MolecularWeight: 444.47916

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(NC3=C2C4=CC=CC=C4C=C3)C5=CC(=C(C=C5[N+](=O)[O-])O)OC)C(=O)C1)C

Isomeric SMILES

CC1(CC2=C(C(NC3=C2C4=CC=CC=C4C=C3)C5=CC(=C(C=C5[N+](=O)[O-])O)OC)C(=O)C1)C

InChI

InChI=1S/C26H24N2O5/c1-26(2)12-17-23-15-7-5-4-6-14(15)8-9-18(23)27-25(24(17)21(30)13-26)16-10-22(33-3)20(29)11-19(16)28(31)32/h4-11,25,27,29H,12-13H2,1-3H3