2-(dimethylamino)-5-nitro-N-[1-(phenylmethyl)-4,5,6,7-tetrahydroindazol-4-yl]benzamide

Systemtic Name: 2-(dimethylamino)-5-nitro-N-[1-(phenylmethyl)-4,5,6,7-tetrahydroindazol-4-yl]benzamide Openeye Name: N-(1-benzyl-4,5,6,7-tetrahydroindazol-4-yl)-2-(dimethylamino)-5-nitro-benzamide CAS Name: 2-(dimethylamino)-5-nitro-N-[1-(phenylmethyl)-4,5,6,7-tetrahydroindazol-4-yl]benzamide IUPAC Name: N-(1-benzyl-4,5,6,7-tetrahydroindazol-4-yl)-2-(dimethylamino)-5-nitrobenzamide Traditional Name: N-(1-benzyl-4,5,6,7-tetrahydroindazol-4-yl)-2-(dimethylamino)-5-nitro-benzamide Formula: C23H25N5O3 MolecularWeight: 419.4763

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C=C(C=C1)[N+](=O)[O-])C(=O)NC2CCCC3=C2C=NN3CC4=CC=CC=C4

Isomeric SMILES

CN(C)C1=C(C=C(C=C1)[N+](=O)[O-])C(=O)NC2CCCC3=C2C=NN3CC4=CC=CC=C4

InChI

InChI=1S/C23H25N5O3/c1-26(2)21-12-11-17(28(30)31)13-18(21)23(29)25-20-9-6-10-22-19(20)14-24-27(22)15-16-7-4-3-5-8-16/h3-5,7-8,11-14,20H,6,9-10,15H2,1-2H3,(H,25,29)