3-[[(6-oxidanylidene-5,10b-dihydro-4aH-phenanthridin-2-yl)amino]methyl]benzenecarbonitrile

Systemtic Name: 3-[[(6-oxidanylidene-5,10b-dihydro-4aH-phenanthridin-2-yl)amino]methyl]benzenecarbonitrile Openeye Name: 3-[[(6-oxo-5,10b-dihydro-4aH-phenanthridin-2-yl)amino]methyl]benzonitrile CAS Name: 3-[[(6-oxo-5,10b-dihydro-4aH-phenanthridin-2-yl)amino]methyl]benzonitrile IUPAC Name: 3-[[(6-oxo-5,10b-dihydro-4aH-phenanthridin-2-yl)amino]methyl]benzonitrile Traditional Name: 3-[[(6-keto-5,10b-dihydro-4aH-phenanthridin-2-yl)amino]methyl]benzonitrile Formula: C21H17N3O MolecularWeight: 327.37918

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C3C=C(C=CC3NC2=O)NCC4=CC=CC(=C4)C#N

Isomeric SMILES

C1=CC=C2C(=C1)C3C=C(C=CC3NC2=O)NCC4=CC=CC(=C4)C#N

InChI

InChI=1S/C21H17N3O/c22-12-14-4-3-5-15(10-14)13-23-16-8-9-20-19(11-16)17-6-1-2-7-18(17)21(25)24-20/h1-11,19-20,23H,13H2,(H,24,25)