[7-(4-dimethylaminophenyl)-7-bicyclo[2.2.1]hept-2-enyl] 4-nitrobenzoate

Systemtic Name: [7-(4-dimethylaminophenyl)-7-bicyclo[2.2.1]hept-2-enyl] 4-nitrobenzoate Openeye Name: [7-(4-dimethylaminophenyl)-7-bicyclo[2.2.1]hept-2-enyl] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [7-(4-dimethylaminophenyl)-7-bicyclo[2.2.1]hept-2-enyl] ester IUPAC Name: [7-(4-dimethylaminophenyl)-7-bicyclo[2.2.1]hept-2-enyl] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [7-(4-dimethylaminophenyl)-7-bicyclo[2.2.1]hept-2-enyl] ester Formula: C22H22N2O4 MolecularWeight: 378.42108

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C2(C3CCC2C=C3)OC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C2(C3CCC2C=C3)OC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H22N2O4/c1-23(2)19-13-9-18(10-14-19)22(16-5-6-17(22)8-7-16)28-21(25)15-3-11-20(12-4-15)24(26)27/h3-6,9-14,16-17H,7-8H2,1-2H3