5-(7-methoxy-1,3-benzodioxol-5-yl)-2,2-dimethyl-1,3,5,6-tetrahydrobenzo[a]phenanthridin-4-one

Systemtic Name: 5-(7-methoxy-1,3-benzodioxol-5-yl)-2,2-dimethyl-1,3,5,6-tetrahydrobenzo[a]phenanthridin-4-one Openeye Name: 5-(7-methoxy-1,3-benzodioxol-5-yl)-2,2-dimethyl-1,3,5,6-tetrahydrobenzo[a]phenanthridin-4-one CAS Name: 5-(7-methoxy-1,3-benzodioxol-5-yl)-2,2-dimethyl-1,3,5,6-tetrahydrobenzo[a]phenanthridin-4-one IUPAC Name: 5-(7-methoxy-1,3-benzodioxol-5-yl)-2,2-dimethyl-1,3,5,6-tetrahydrobenzo[a]phenanthridin-4-one Traditional Name: 5-(7-methoxy-1,3-benzodioxol-5-yl)-2,2-dimethyl-1,3,5,6-tetrahydrobenzo[a]phenanthridin-4-one Formula: C27H25NO4 MolecularWeight: 427.4917

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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)OC)OCO6)C(=O)C1)C

Isomeric SMILES

CC1(CC2=C(C(NC3=C2C4=CC=CC=C4C=C3)C5=CC6=C(C(=C5)OC)OCO6)C(=O)C1)C

InChI

InChI=1S/C27H25NO4/c1-27(2)12-18-23-17-7-5-4-6-15(17)8-9-19(23)28-25(24(18)20(29)13-27)16-10-21(30-3)26-22(11-16)31-14-32-26/h4-11,25,28H,12-14H2,1-3H3