5-nitro-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]-1H-indazole-3-carboxamide

Systemtic Name: 5-nitro-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]-1H-indazole-3-carboxamide Openeye Name: 5-nitro-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]-1H-indazole-3-carboxamide CAS Name: 5-nitro-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]-1H-indazole-3-carboxamide IUPAC Name: 5-nitro-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]-1H-indazole-3-carboxamide Traditional Name: 5-nitro-N-[4-(1,2,4-triazol-1-ylmethyl)benzyl]-1H-indazole-3-carboxamide Formula: C18H15N7O3 MolecularWeight: 377.3568

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC(=O)C2=NNC3=C2C=C(C=C3)[N+](=O)[O-])CN4C=NC=N4

Isomeric SMILES

C1=CC(=CC=C1CNC(=O)C2=NNC3=C2C=C(C=C3)[N+](=O)[O-])CN4C=NC=N4

InChI

InChI=1S/C18H15N7O3/c26-18(17-15-7-14(25(27)28)5-6-16(15)22-23-17)20-8-12-1-3-13(4-2-12)9-24-11-19-10-21-24/h1-7,10-11H,8-9H2,(H,20,26)(H,22,23)