(2Z)-3-(azepan-1-yl)-2-[(3,4-dichlorophenyl)hydrazinylidene]-3-oxidanylidene-propanenitrile

Systemtic Name: (2Z)-3-(azepan-1-yl)-2-[(3,4-dichlorophenyl)hydrazinylidene]-3-oxidanylidene-propanenitrile Openeye Name: (1Z)-2-(azepan-1-yl)-N-(3,4-dichloroanilino)-2-oxo-acetimidoyl cyanide CAS Name: (2Z)-3-(1-azepanyl)-2-[(3,4-dichlorophenyl)hydrazinylidene]-3-oxopropanenitrile IUPAC Name: (1Z)-2-(azepan-1-yl)-N-(3,4-dichloroanilino)-2-oxoethanimidoyl cyanide Traditional Name: (2Z)-3-(azepan-1-yl)-2-[(3,4-dichlorophenyl)hydrazono]-3-keto-propionitrile Formula: C15H16Cl2N4O MolecularWeight: 339.21974

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C(=NNC2=CC(=C(C=C2)Cl)Cl)C#N

Isomeric SMILES

C1CCCN(CC1)C(=O)/C(=N\NC2=CC(=C(C=C2)Cl)Cl)/C#N

InChI

InChI=1S/C15H16Cl2N4O/c16-12-6-5-11(9-13(12)17)19-20-14(10-18)15(22)21-7-3-1-2-4-8-21/h5-6,9,19H,1-4,7-8H2/b20-14-