tert-butyl 4-(2-methylphenyl)-3-oxidanylidene-piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-(2-methylphenyl)-3-oxidanylidene-piperazine-1-carboxylate Openeye Name: tert-butyl 4-(o-tolyl)-3-oxo-piperazine-1-carboxylate CAS Name: 4-(2-methylphenyl)-3-oxo-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(2-methylphenyl)-3-oxopiperazine-1-carboxylate Traditional Name: 3-keto-4-(o-tolyl)piperazine-1-carboxylic acid tert-butyl ester Formula: C16H22N2O3 MolecularWeight: 290.35748

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2CCN(CC2=O)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC=CC=C1N2CCN(CC2=O)C(=O)OC(C)(C)C

InChI

InChI=1S/C16H22N2O3/c1-12-7-5-6-8-13(12)18-10-9-17(11-14(18)19)15(20)21-16(2,3)4/h5-8H,9-11H2,1-4H3