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

Systemtic Name: 2-methoxy-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-methoxy-5-nitro-benzamide CAS Name: 2-methoxy-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-methoxy-5-nitrobenzamide Traditional Name: N-(1-benzyl-4,5,6,7-tetrahydroindazol-4-yl)-2-methoxy-5-nitro-benzamide Formula: C22H22N4O4 MolecularWeight: 406.43448

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)NC2CCCC3=C2C=NN3CC4=CC=CC=C4

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)NC2CCCC3=C2C=NN3CC4=CC=CC=C4

InChI

InChI=1S/C22H22N4O4/c1-30-21-11-10-16(26(28)29)12-17(21)22(27)24-19-8-5-9-20-18(19)13-23-25(20)14-15-6-3-2-4-7-15/h2-4,6-7,10-13,19H,5,8-9,14H2,1H3,(H,24,27)