N-[(E)-(4-morpholin-4-yl-3-nitro-phenyl)methylideneamino]-1,2,4-triazol-4-amine

Systemtic Name: N-[(E)-(4-morpholin-4-yl-3-nitro-phenyl)methylideneamino]-1,2,4-triazol-4-amine Openeye Name: N-[(E)-(4-morpholino-3-nitro-phenyl)methyleneamino]-1,2,4-triazol-4-amine CAS Name: N-[(E)-[4-(4-morpholinyl)-3-nitrophenyl]methylideneamino]-1,2,4-triazol-4-amine IUPAC Name: N-[(E)-(4-morpholin-4-yl-3-nitrophenyl)methylideneamino]-1,2,4-triazol-4-amine Traditional Name: [(E)-(4-morpholino-3-nitro-benzylidene)amino]-(1,2,4-triazol-4-yl)amine Formula: C13H15N7O3 MolecularWeight: 317.3033

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)C=NNN3C=NN=C3)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)/C=N/NN3C=NN=C3)[N+](=O)[O-]

InChI

InChI=1S/C13H15N7O3/c21-20(22)13-7-11(8-14-17-19-9-15-16-10-19)1-2-12(13)18-3-5-23-6-4-18/h1-2,7-10,17H,3-6H2/b14-8+