N-(1,4,5,6,7,8-hexahydrocyclohepta[c]pyrazol-3-yl)-2-nitro-benzamide

Systemtic Name: N-(1,4,5,6,7,8-hexahydrocyclohepta[c]pyrazol-3-yl)-2-nitro-benzamide Openeye Name: N-(1,4,5,6,7,8-hexahydrocyclohepta[c]pyrazol-3-yl)-2-nitro-benzamide CAS Name: N-(1,4,5,6,7,8-hexahydrocyclohepta[c]pyrazol-3-yl)-2-nitrobenzamide IUPAC Name: N-(1,4,5,6,7,8-hexahydrocyclohepta[c]pyrazol-3-yl)-2-nitrobenzamide Traditional Name: N-(1,4,5,6,7,8-hexahydrocyclohepta[c]pyrazol-3-yl)-2-nitro-benzamide Formula: C15H16N4O3 MolecularWeight: 300.31254

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(CC1)NN=C2NC(=O)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

C1CCC2=C(CC1)NN=C2NC(=O)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C15H16N4O3/c20-15(11-7-4-5-9-13(11)19(21)22)16-14-10-6-2-1-3-8-12(10)17-18-14/h4-5,7,9H,1-3,6,8H2,(H2,16,17,18,20)