(1S,5R)-N-(2-methyl-4-nitro-phenyl)-7-phenyl-bicyclo[3.1.1]heptane-6-carboxamide

Systemtic Name: (1S,5R)-N-(2-methyl-4-nitro-phenyl)-7-phenyl-bicyclo[3.1.1]heptane-6-carboxamide Openeye Name: (1S,5R)-N-(2-methyl-4-nitro-phenyl)-7-phenyl-norpinane-6-carboxamide CAS Name: (1S,5R)-N-(2-methyl-4-nitrophenyl)-7-phenyl-6-bicyclo[3.1.1]heptanecarboxamide IUPAC Name: (1S,5R)-N-(2-methyl-4-nitrophenyl)-7-phenylbicyclo[3.1.1]heptane-6-carboxamide Traditional Name: (1S,5R)-N-(2-methyl-4-nitro-phenyl)-7-phenyl-norpinane-6-carboxamide Formula: C21H22N2O3 MolecularWeight: 350.41098

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)C2C3CCCC2C3C4=CC=CC=C4

Isomeric SMILES

CC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)C2[C@@H]3CCC[C@H]2C3C4=CC=CC=C4

InChI

InChI=1S/C21H22N2O3/c1-13-12-15(23(25)26)10-11-18(13)22-21(24)20-16-8-5-9-17(20)19(16)14-6-3-2-4-7-14/h2-4,6-7,10-12,16-17,19-20H,5,8-9H2,1H3,(H,22,24)/t16-,17+,19?,20?