[4-(3,3-dimethylbutylcarbamoyl)phenyl] 4-[2-(6-methylpyridin-2-yl)ethyl]piperazine-1-carboxylate

Systemtic Name: [4-(3,3-dimethylbutylcarbamoyl)phenyl] 4-[2-(6-methylpyridin-2-yl)ethyl]piperazine-1-carboxylate Openeye Name: [4-(3,3-dimethylbutylcarbamoyl)phenyl] 4-[2-(6-methyl-2-pyridyl)ethyl]piperazine-1-carboxylate CAS Name: 4-[2-(6-methyl-2-pyridinyl)ethyl]-1-piperazinecarboxylic acid [4-[(3,3-dimethylbutylamino)-oxomethyl]phenyl] ester IUPAC Name: [4-(3,3-dimethylbutylcarbamoyl)phenyl] 4-[2-(6-methylpyridin-2-yl)ethyl]piperazine-1-carboxylate Traditional Name: 4-[2-(6-methyl-2-pyridyl)ethyl]piperazine-1-carboxylic acid [4-(3,3-dimethylbutylcarbamoyl)phenyl] ester Formula: C26H36N4O3 MolecularWeight: 452.58904

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC=C1)CCN2CCN(CC2)C(=O)OC3=CC=C(C=C3)C(=O)NCCC(C)(C)C

Isomeric SMILES

CC1=NC(=CC=C1)CCN2CCN(CC2)C(=O)OC3=CC=C(C=C3)C(=O)NCCC(C)(C)C

InChI

InChI=1S/C26H36N4O3/c1-20-6-5-7-22(28-20)12-15-29-16-18-30(19-17-29)25(32)33-23-10-8-21(9-11-23)24(31)27-14-13-26(2,3)4/h5-11H,12-19H2,1-4H3,(H,27,31)