[4-(3,3-dimethylbutylcarbamoyl)phenyl] 4-(5-methylpyridin-2-yl)piperazine-1-carboxylate

Systemtic Name: [4-(3,3-dimethylbutylcarbamoyl)phenyl] 4-(5-methylpyridin-2-yl)piperazine-1-carboxylate Openeye Name: [4-(3,3-dimethylbutylcarbamoyl)phenyl] 4-(5-methyl-2-pyridyl)piperazine-1-carboxylate CAS Name: 4-(5-methyl-2-pyridinyl)-1-piperazinecarboxylic acid [4-[(3,3-dimethylbutylamino)-oxomethyl]phenyl] ester IUPAC Name: [4-(3,3-dimethylbutylcarbamoyl)phenyl] 4-(5-methylpyridin-2-yl)piperazine-1-carboxylate Traditional Name: 4-(5-methyl-2-pyridyl)piperazine-1-carboxylic acid [4-(3,3-dimethylbutylcarbamoyl)phenyl] ester Formula: C24H32N4O3 MolecularWeight: 424.53588

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C=C1)N2CCN(CC2)C(=O)OC3=CC=C(C=C3)C(=O)NCCC(C)(C)C

Isomeric SMILES

CC1=CN=C(C=C1)N2CCN(CC2)C(=O)OC3=CC=C(C=C3)C(=O)NCCC(C)(C)C

InChI

InChI=1S/C24H32N4O3/c1-18-5-10-21(26-17-18)27-13-15-28(16-14-27)23(30)31-20-8-6-19(7-9-20)22(29)25-12-11-24(2,3)4/h5-10,17H,11-16H2,1-4H3,(H,25,29)