tert-butyl 4-(2-benzamido-3-methyl-pentanoyl)piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-(2-benzamido-3-methyl-pentanoyl)piperazine-1-carboxylate Openeye Name: tert-butyl 4-(2-benzamido-3-methyl-pentanoyl)piperazine-1-carboxylate CAS Name: 4-(2-benzamido-3-methyl-1-oxopentyl)-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(2-benzamido-3-methylpentanoyl)piperazine-1-carboxylate Traditional Name: 4-(2-benzamido-3-methyl-pentanoyl)piperazine-1-carboxylic acid tert-butyl ester Formula: C22H33N3O4 MolecularWeight: 403.51512

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)N1CCN(CC1)C(=O)OC(C)(C)C)NC(=O)C2=CC=CC=C2

Isomeric SMILES

CCC(C)C(C(=O)N1CCN(CC1)C(=O)OC(C)(C)C)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C22H33N3O4/c1-6-16(2)18(23-19(26)17-10-8-7-9-11-17)20(27)24-12-14-25(15-13-24)21(28)29-22(3,4)5/h7-11,16,18H,6,12-15H2,1-5H3,(H,23,26)