N-[4-(2-cyanopropan-2-yl)phenyl]-5-nitro-1H-indazole-3-carboxamide

Systemtic Name: N-[4-(2-cyanopropan-2-yl)phenyl]-5-nitro-1H-indazole-3-carboxamide Openeye Name: N-[4-(1-cyano-1-methyl-ethyl)phenyl]-5-nitro-1H-indazole-3-carboxamide CAS Name: N-[4-(2-cyanopropan-2-yl)phenyl]-5-nitro-1H-indazole-3-carboxamide IUPAC Name: N-[4-(2-cyanopropan-2-yl)phenyl]-5-nitro-1H-indazole-3-carboxamide Traditional Name: N-[4-(1-cyano-1-methyl-ethyl)phenyl]-5-nitro-1H-indazole-3-carboxamide Formula: C18H15N5O3 MolecularWeight: 349.3434

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H15N5O3/c1-18(2,10-19)11-3-5-12(6-4-11)20-17(24)16-14-9-13(23(25)26)7-8-15(14)21-22-16/h3-9H,1-2H3,(H,20,24)(H,21,22)