4-[[bis(azanyl)methylideneamino]methyl]-N-(4-nitrophenyl)cyclohexane-1-carboxamide

Systemtic Name: 4-[[bis(azanyl)methylideneamino]methyl]-N-(4-nitrophenyl)cyclohexane-1-carboxamide Openeye Name: 4-(guanidinomethyl)-N-(4-nitrophenyl)cyclohexanecarboxamide CAS Name: 4-[(diaminomethylideneamino)methyl]-N-(4-nitrophenyl)-1-cyclohexanecarboxamide IUPAC Name: 4-[(diaminomethylideneamino)methyl]-N-(4-nitrophenyl)cyclohexane-1-carboxamide Traditional Name: 4-(guanidinomethyl)-N-(4-nitrophenyl)cyclohexanecarboxamide Formula: C15H21N5O3 MolecularWeight: 319.35894

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1CN=C(N)N)C(=O)NC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1CC(CCC1CN=C(N)N)C(=O)NC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H21N5O3/c16-15(17)18-9-10-1-3-11(4-2-10)14(21)19-12-5-7-13(8-6-12)20(22)23/h5-8,10-11H,1-4,9H2,(H,19,21)(H4,16,17,18)