N-[1-(9-bicyclo[3.3.1]nonanyl)pyrrolidin-3-yl]-4-cyclohexyloxy-2-methoxy-5-nitro-benzamide

Systemtic Name: N-[1-(9-bicyclo[3.3.1]nonanyl)pyrrolidin-3-yl]-4-cyclohexyloxy-2-methoxy-5-nitro-benzamide Openeye Name: N-[1-(9-bicyclo[3.3.1]nonanyl)pyrrolidin-3-yl]-4-(cyclohexoxy)-2-methoxy-5-nitro-benzamide CAS Name: N-[1-(9-bicyclo[3.3.1]nonanyl)-3-pyrrolidinyl]-4-cyclohexyloxy-2-methoxy-5-nitrobenzamide IUPAC Name: N-[1-(9-bicyclo[3.3.1]nonanyl)pyrrolidin-3-yl]-4-cyclohexyloxy-2-methoxy-5-nitrobenzamide Traditional Name: N-[1-(9-bicyclo[3.3.1]nonanyl)pyrrolidin-3-yl]-4-(cyclohexoxy)-2-methoxy-5-nitro-benzamide Formula: C27H39N3O5 MolecularWeight: 485.61566

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C(=O)NC2CCN(C2)C3C4CCCC3CCC4)[N+](=O)[O-])OC5CCCCC5

Isomeric SMILES

COC1=CC(=C(C=C1C(=O)NC2CCN(C2)C3C4CCCC3CCC4)[N+](=O)[O-])OC5CCCCC5

InChI

InChI=1S/C27H39N3O5/c1-34-24-16-25(35-21-11-3-2-4-12-21)23(30(32)33)15-22(24)27(31)28-20-13-14-29(17-20)26-18-7-5-8-19(26)10-6-9-18/h15-16,18-21,26H,2-14,17H2,1H3,(H,28,31)