(6aS,7R,10aS)-7-methoxy-5-methyl-6-oxidanylidene-10,10a-dihydro-7H-phenanthridine-6a-carbonitrile

Systemtic Name: (6aS,7R,10aS)-7-methoxy-5-methyl-6-oxidanylidene-10,10a-dihydro-7H-phenanthridine-6a-carbonitrile Openeye Name: (6aS,7R,10aS)-7-methoxy-5-methyl-6-oxo-10,10a-dihydro-7H-phenanthridine-6a-carbonitrile CAS Name: (6aS,7R,10aS)-7-methoxy-5-methyl-6-oxo-10,10a-dihydro-7H-phenanthridine-6a-carbonitrile IUPAC Name: (6aS,7R,10aS)-7-methoxy-5-methyl-6-oxo-10,10a-dihydro-7H-phenanthridine-6a-carbonitrile Traditional Name: (6aS,7R,10aS)-6-keto-7-methoxy-5-methyl-10,10a-dihydro-7H-phenanthridine-6a-carbonitrile Formula: C16H16N2O2 MolecularWeight: 268.31044

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C3CC=CC(C3(C1=O)C#N)OC

Isomeric SMILES

CN1C2=CC=CC=C2[C@@H]3CC=C[C@H]([C@@]3(C1=O)C#N)OC

InChI

InChI=1S/C16H16N2O2/c1-18-13-8-4-3-6-11(13)12-7-5-9-14(20-2)16(12,10-17)15(18)19/h3-6,8-9,12,14H,7H2,1-2H3/t12-,14+,16+/m0/s1