1-(1-adamantylcarbonyl)-N-(2-methyl-5-nitro-phenyl)pyrrolidine-2-carboxamide

Systemtic Name: 1-(1-adamantylcarbonyl)-N-(2-methyl-5-nitro-phenyl)pyrrolidine-2-carboxamide Openeye Name: 1-(adamantane-1-carbonyl)-N-(2-methyl-5-nitro-phenyl)pyrrolidine-2-carboxamide CAS Name: 1-[1-adamantyl(oxo)methyl]-N-(2-methyl-5-nitrophenyl)-2-pyrrolidinecarboxamide IUPAC Name: 1-(adamantane-1-carbonyl)-N-(2-methyl-5-nitrophenyl)pyrrolidine-2-carboxamide Traditional Name: 1-(adamantane-1-carbonyl)-N-(2-methyl-5-nitro-phenyl)pyrrolidine-2-carboxamide Formula: C23H29N3O4 MolecularWeight: 411.49406

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)C2CCCN2C(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)C2CCCN2C(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C23H29N3O4/c1-14-4-5-18(26(29)30)10-19(14)24-21(27)20-3-2-6-25(20)22(28)23-11-15-7-16(12-23)9-17(8-15)13-23/h4-5,10,15-17,20H,2-3,6-9,11-13H2,1H3,(H,24,27)