1,3-diethyl-4-oxidanylidene-3,6-dihydro-2H-[1,2]diazepino[4,3-b]quinoxaline-5-carbonitrile

Systemtic Name: 1,3-diethyl-4-oxidanylidene-3,6-dihydro-2H-[1,2]diazepino[4,3-b]quinoxaline-5-carbonitrile Openeye Name: 1,3-diethyl-4-oxo-3,6-dihydro-2H-diazepino[4,3-b]quinoxaline-5-carbonitrile CAS Name: 1,3-diethyl-4-oxo-3,6-dihydro-2H-diazepino[4,3-b]quinoxaline-5-carbonitrile IUPAC Name: 1,3-diethyl-4-oxo-3,6-dihydro-2H-diazepino[4,3-b]quinoxaline-5-carbonitrile Traditional Name: 1,3-diethyl-4-keto-3,6-dihydro-2H-diazepino[4,3-b]quinoxaline-5-carbonitrile Formula: C16H17N5O MolecularWeight: 295.33908

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=O)C(=C2C(=NC3=CC=CC=C3N2)N(N1)CC)C#N

Isomeric SMILES

CCC1C(=O)C(=C2C(=NC3=CC=CC=C3N2)N(N1)CC)C#N

InChI

InChI=1S/C16H17N5O/c1-3-11-15(22)10(9-17)14-16(21(4-2)20-11)19-13-8-6-5-7-12(13)18-14/h5-8,11,18,20H,3-4H2,1-2H3