(2R)-1-(1-adamantylcarbonyl)-N-(2-bromanyl-4-methyl-phenyl)pyrrolidine-2-carboxamide

Systemtic Name: (2R)-1-(1-adamantylcarbonyl)-N-(2-bromanyl-4-methyl-phenyl)pyrrolidine-2-carboxamide Openeye Name: (2R)-1-(adamantane-1-carbonyl)-N-(2-bromo-4-methyl-phenyl)pyrrolidine-2-carboxamide CAS Name: (2R)-1-[1-adamantyl(oxo)methyl]-N-(2-bromo-4-methylphenyl)-2-pyrrolidinecarboxamide IUPAC Name: (2R)-1-(adamantane-1-carbonyl)-N-(2-bromo-4-methylphenyl)pyrrolidine-2-carboxamide Traditional Name: (2R)-1-(adamantane-1-carbonyl)-N-(2-bromo-4-methyl-phenyl)pyrrolidine-2-carboxamide Formula: C23H29BrN2O2 MolecularWeight: 445.39256

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C2CCCN2C(=O)C34CC5CC(C3)CC(C5)C4)Br

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)[C@H]2CCCN2C(=O)C34CC5CC(C3)CC(C5)C4)Br

InChI

InChI=1S/C23H29BrN2O2/c1-14-4-5-19(18(24)7-14)25-21(27)20-3-2-6-26(20)22(28)23-11-15-8-16(12-23)10-17(9-15)13-23/h4-5,7,15-17,20H,2-3,6,8-13H2,1H3,(H,25,27)/t15?,16?,17?,20-,23?/m1/s1