N-(4-acetamido-3-methyl-phenyl)-1-(1-adamantylcarbonyl)pyrrolidine-2-carboxamide

Systemtic Name: N-(4-acetamido-3-methyl-phenyl)-1-(1-adamantylcarbonyl)pyrrolidine-2-carboxamide Openeye Name: N-(4-acetamido-3-methyl-phenyl)-1-(adamantane-1-carbonyl)pyrrolidine-2-carboxamide CAS Name: N-(4-acetamido-3-methylphenyl)-1-[1-adamantyl(oxo)methyl]-2-pyrrolidinecarboxamide IUPAC Name: N-(4-acetamido-3-methylphenyl)-1-(adamantane-1-carbonyl)pyrrolidine-2-carboxamide Traditional Name: N-(4-acetamido-3-methyl-phenyl)-1-(adamantane-1-carbonyl)pyrrolidine-2-carboxamide Formula: C25H33N3O3 MolecularWeight: 423.54782

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H33N3O3/c1-15-8-20(5-6-21(15)26-16(2)29)27-23(30)22-4-3-7-28(22)24(31)25-12-17-9-18(13-25)11-19(10-17)14-25/h5-6,8,17-19,22H,3-4,7,9-14H2,1-2H3,(H,26,29)(H,27,30)