N-[(E)-1-(3-nitro-1,2,4-triazol-1-yl)propan-2-ylideneamino]-1H-indole-3-carboxamide

Systemtic Name: N-[(E)-1-(3-nitro-1,2,4-triazol-1-yl)propan-2-ylideneamino]-1H-indole-3-carboxamide Openeye Name: N-[(E)-[1-methyl-2-(3-nitro-1,2,4-triazol-1-yl)ethylidene]amino]-1H-indole-3-carboxamide CAS Name: N-[(E)-1-(3-nitro-1,2,4-triazol-1-yl)propan-2-ylideneamino]-1H-indole-3-carboxamide IUPAC Name: N-[(E)-1-(3-nitro-1,2,4-triazol-1-yl)propan-2-ylideneamino]-1H-indole-3-carboxamide Traditional Name: N-[(E)-[1-methyl-2-(3-nitro-1,2,4-triazol-1-yl)ethylidene]amino]-1H-indole-3-carboxamide Formula: C14H13N7O3 MolecularWeight: 327.29812

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=CNC2=CC=CC=C21)CN3C=NC(=N3)[N+](=O)[O-]

Isomeric SMILES

C/C(=N\NC(=O)C1=CNC2=CC=CC=C21)/CN3C=NC(=N3)[N+](=O)[O-]

InChI

InChI=1S/C14H13N7O3/c1-9(7-20-8-16-14(19-20)21(23)24)17-18-13(22)11-6-15-12-5-3-2-4-10(11)12/h2-6,8,15H,7H2,1H3,(H,18,22)/b17-9+