6-(3-methoxy-4-oxidanyl-phenyl)-5,6,6a,7,8,12b-hexahydrobenzo[k]phenanthridine-2-carbonitrile

Systemtic Name: 6-(3-methoxy-4-oxidanyl-phenyl)-5,6,6a,7,8,12b-hexahydrobenzo[k]phenanthridine-2-carbonitrile Openeye Name: 6-(4-hydroxy-3-methoxy-phenyl)-5,6,6a,7,8,12b-hexahydrobenzo[k]phenanthridine-2-carbonitrile CAS Name: 6-(4-hydroxy-3-methoxyphenyl)-5,6,6a,7,8,12b-hexahydrobenzo[k]phenanthridine-2-carbonitrile IUPAC Name: 6-(4-hydroxy-3-methoxyphenyl)-5,6,6a,7,8,12b-hexahydrobenzo[k]phenanthridine-2-carbonitrile Traditional Name: 6-(4-hydroxy-3-methoxy-phenyl)-5,6,6a,7,8,12b-hexahydrobenzo[k]phenanthridine-2-carbonitrile Formula: C25H22N2O2 MolecularWeight: 382.45438

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C2C3CCC4=CC=CC=C4C3C5=C(N2)C=CC(=C5)C#N)O

Isomeric SMILES

COC1=C(C=CC(=C1)C2C3CCC4=CC=CC=C4C3C5=C(N2)C=CC(=C5)C#N)O

InChI

InChI=1S/C25H22N2O2/c1-29-23-13-17(8-11-22(23)28)25-19-9-7-16-4-2-3-5-18(16)24(19)20-12-15(14-26)6-10-21(20)27-25/h2-6,8,10-13,19,24-25,27-28H,7,9H2,1H3