3-azanyl-1-oxidanylidene-5,10-dihydro-2H-azepino[3,4-b]indole-4-carbonitrile

Systemtic Name: 3-azanyl-1-oxidanylidene-5,10-dihydro-2H-azepino[3,4-b]indole-4-carbonitrile Openeye Name: 3-amino-1-oxo-5,10-dihydro-2H-azepino[3,4-b]indole-4-carbonitrile CAS Name: 3-amino-1-oxo-5,10-dihydro-2H-azepino[3,4-b]indole-4-carbonitrile IUPAC Name: 3-amino-1-oxo-5,10-dihydro-2H-azepino[3,4-b]indole-4-carbonitrile Traditional Name: 3-amino-1-keto-5,10-dihydro-2H-azepin[3,4-b]indole-4-carbonitrile Formula: C13H10N4O MolecularWeight: 238.2447

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=C(NC(=O)C2=C1C3=CC=CC=C3N2)N)C#N

Isomeric SMILES

C1C(=C(NC(=O)C2=C1C3=CC=CC=C3N2)N)C#N

InChI

InChI=1S/C13H10N4O/c14-6-7-5-9-8-3-1-2-4-10(8)16-11(9)13(18)17-12(7)15/h1-4,16H,5,15H2,(H,17,18)