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

Systemtic Name: 5-(1,3-benzodioxol-5-yl)-3,3-dimethyl-2,4,5,6-tetrahydrobenzo[a]phenanthridin-1-one Openeye Name: 5-(1,3-benzodioxol-5-yl)-3,3-dimethyl-2,4,5,6-tetrahydrobenzo[a]phenanthridin-1-one CAS Name: 5-(1,3-benzodioxol-5-yl)-3,3-dimethyl-2,4,5,6-tetrahydrobenzo[a]phenanthridin-1-one IUPAC Name: 5-(1,3-benzodioxol-5-yl)-3,3-dimethyl-2,4,5,6-tetrahydrobenzo[a]phenanthridin-1-one Traditional Name: 5-(1,3-benzodioxol-5-yl)-3,3-dimethyl-2,4,5,6-tetrahydrobenzo[a]phenanthridin-1-one Formula: C26H23NO3 MolecularWeight: 397.46572

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(=O)C1)C3=C(C=CC4=CC=CC=C43)NC2C5=CC6=C(C=C5)OCO6)C

Isomeric SMILES

CC1(CC2=C(C(=O)C1)C3=C(C=CC4=CC=CC=C43)NC2C5=CC6=C(C=C5)OCO6)C

InChI

InChI=1S/C26H23NO3/c1-26(2)12-18-24(20(28)13-26)23-17-6-4-3-5-15(17)7-9-19(23)27-25(18)16-8-10-21-22(11-16)30-14-29-21/h3-11,25,27H,12-14H2,1-2H3