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

Systemtic Name: [4-(3,3-dimethylbutylcarbamoyl)phenyl] 4-[2-(5-methylpyridin-2-yl)ethyl]piperazine-1-carboxylate Openeye Name: [4-(3,3-dimethylbutylcarbamoyl)phenyl] 4-[2-(5-methyl-2-pyridyl)ethyl]piperazine-1-carboxylate CAS Name: 4-[2-(5-methyl-2-pyridinyl)ethyl]-1-piperazinecarboxylic acid [4-[(3,3-dimethylbutylamino)-oxomethyl]phenyl] ester IUPAC Name: [4-(3,3-dimethylbutylcarbamoyl)phenyl] 4-[2-(5-methylpyridin-2-yl)ethyl]piperazine-1-carboxylate Traditional Name: 4-[2-(5-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=CN=C(C=C1)CCN2CCN(CC2)C(=O)OC3=CC=C(C=C3)C(=O)NCCC(C)(C)C

Isomeric SMILES

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

InChI

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