tert-butyl 4-[2-(methylamino)-3-phenyl-propanoyl]-3-(2-methylpropyl)piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[2-(methylamino)-3-phenyl-propanoyl]-3-(2-methylpropyl)piperazine-1-carboxylate Openeye Name: tert-butyl 3-isobutyl-4-[2-(methylamino)-3-phenyl-propanoyl]piperazine-1-carboxylate CAS Name: 4-[2-(methylamino)-1-oxo-3-phenylpropyl]-3-(2-methylpropyl)-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[2-(methylamino)-3-phenylpropanoyl]-3-(2-methylpropyl)piperazine-1-carboxylate Traditional Name: 3-isobutyl-4-[2-(methylamino)-3-phenyl-propanoyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C23H37N3O3 MolecularWeight: 403.55818

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1CN(CCN1C(=O)C(CC2=CC=CC=C2)NC)C(=O)OC(C)(C)C

Isomeric SMILES

CC(C)CC1CN(CCN1C(=O)C(CC2=CC=CC=C2)NC)C(=O)OC(C)(C)C

InChI

InChI=1S/C23H37N3O3/c1-17(2)14-19-16-25(22(28)29-23(3,4)5)12-13-26(19)21(27)20(24-6)15-18-10-8-7-9-11-18/h7-11,17,19-20,24H,12-16H2,1-6H3