tert-butyl 4-(2-azanyl-3-phenyl-propanoyl)-3-(2-methylpropyl)piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-(2-azanyl-3-phenyl-propanoyl)-3-(2-methylpropyl)piperazine-1-carboxylate Openeye Name: tert-butyl 4-(2-amino-3-phenyl-propanoyl)-3-isobutyl-piperazine-1-carboxylate CAS Name: 4-(2-amino-1-oxo-3-phenylpropyl)-3-(2-methylpropyl)-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(2-amino-3-phenylpropanoyl)-3-(2-methylpropyl)piperazine-1-carboxylate Traditional Name: 3-isobutyl-4-phenylalanyl-piperazine-1-carboxylic acid tert-butyl ester Formula: C22H35N3O3 MolecularWeight: 389.5316

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H35N3O3/c1-16(2)13-18-15-24(21(27)28-22(3,4)5)11-12-25(18)20(26)19(23)14-17-9-7-6-8-10-17/h6-10,16,18-19H,11-15,23H2,1-5H3