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

Systemtic Name: 2,2-dimethyl-5-(6-nitro-1,3-benzodioxol-5-yl)-1,3,5,6-tetrahydrobenzo[a]phenanthridin-4-one Openeye Name: 2,2-dimethyl-5-(6-nitro-1,3-benzodioxol-5-yl)-1,3,5,6-tetrahydrobenzo[a]phenanthridin-4-one CAS Name: 2,2-dimethyl-5-(6-nitro-1,3-benzodioxol-5-yl)-1,3,5,6-tetrahydrobenzo[a]phenanthridin-4-one IUPAC Name: 2,2-dimethyl-5-(6-nitro-1,3-benzodioxol-5-yl)-1,3,5,6-tetrahydrobenzo[a]phenanthridin-4-one Traditional Name: 2,2-dimethyl-5-(6-nitro-1,3-benzodioxol-5-yl)-1,3,5,6-tetrahydrobenzo[a]phenanthridin-4-one Formula: C26H22N2O5 MolecularWeight: 442.46328

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(NC3=C2C4=CC=CC=C4C=C3)C5=CC6=C(C=C5[N+](=O)[O-])OCO6)C(=O)C1)C

Isomeric SMILES

CC1(CC2=C(C(NC3=C2C4=CC=CC=C4C=C3)C5=CC6=C(C=C5[N+](=O)[O-])OCO6)C(=O)C1)C

InChI

InChI=1S/C26H22N2O5/c1-26(2)11-17-23-15-6-4-3-5-14(15)7-8-18(23)27-25(24(17)20(29)12-26)16-9-21-22(33-13-32-21)10-19(16)28(30)31/h3-10,25,27H,11-13H2,1-2H3