(3S)-2-azanylidene-5-(azepan-1-yl)-5-oxidanylidene-pentane-1,1,3-tricarbonitrile

Systemtic Name: (3S)-2-azanylidene-5-(azepan-1-yl)-5-oxidanylidene-pentane-1,1,3-tricarbonitrile Openeye Name: (3S)-5-(azepan-1-yl)-2-imino-5-oxo-pentane-1,1,3-tricarbonitrile CAS Name: (3S)-5-(1-azepanyl)-2-imino-5-oxopentane-1,1,3-tricarbonitrile IUPAC Name: (3S)-5-(azepan-1-yl)-2-imino-5-oxopentane-1,1,3-tricarbonitrile Traditional Name: (3S)-5-(azepan-1-yl)-2-imino-5-keto-pentane-1,1,3-tricarbonitrile Formula: C14H17N5O MolecularWeight: 271.31768

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)CC(C#N)C(=N)C(C#N)C#N

Isomeric SMILES

C1CCCN(CC1)C(=O)C[C@H](C#N)C(=N)C(C#N)C#N

InChI

InChI=1S/C14H17N5O/c15-8-11(14(18)12(9-16)10-17)7-13(20)19-5-3-1-2-4-6-19/h11-12,18H,1-7H2/t11-/m1/s1