N-(9-cyclohexyl-9-azabicyclo[3.3.1]nonan-3-yl)-4-nitro-benzamide

Systemtic Name: N-(9-cyclohexyl-9-azabicyclo[3.3.1]nonan-3-yl)-4-nitro-benzamide Openeye Name: N-(9-cyclohexyl-9-azabicyclo[3.3.1]nonan-3-yl)-4-nitro-benzamide CAS Name: N-(9-cyclohexyl-9-azabicyclo[3.3.1]nonan-3-yl)-4-nitrobenzamide IUPAC Name: N-(9-cyclohexyl-9-azabicyclo[3.3.1]nonan-3-yl)-4-nitrobenzamide Traditional Name: N-(9-cyclohexyl-9-azabicyclo[3.3.1]nonan-3-yl)-4-nitro-benzamide Formula: C21H29N3O3 MolecularWeight: 371.47326

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C3CCCC2CC(C3)NC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1CCC(CC1)N2C3CCCC2CC(C3)NC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H29N3O3/c25-21(15-9-11-18(12-10-15)24(26)27)22-16-13-19-7-4-8-20(14-16)23(19)17-5-2-1-3-6-17/h9-12,16-17,19-20H,1-8,13-14H2,(H,22,25)