tert-butyl 4-[2,3-bis(oxidanylidene)-4-(phenylmethyl)piperazin-1-yl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[2,3-bis(oxidanylidene)-4-(phenylmethyl)piperazin-1-yl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-(4-benzyl-2,3-dioxo-piperazin-1-yl)piperidine-1-carboxylate CAS Name: 4-[2,3-dioxo-4-(phenylmethyl)-1-piperazinyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(4-benzyl-2,3-dioxopiperazin-1-yl)piperidine-1-carboxylate Traditional Name: 4-(4-benzyl-2,3-diketo-piperazino)piperidine-1-carboxylic acid tert-butyl ester Formula: C21H29N3O4 MolecularWeight: 387.47266

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)N2CCN(C(=O)C2=O)CC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)N2CCN(C(=O)C2=O)CC3=CC=CC=C3

InChI

InChI=1S/C21H29N3O4/c1-21(2,3)28-20(27)22-11-9-17(10-12-22)24-14-13-23(18(25)19(24)26)15-16-7-5-4-6-8-16/h4-8,17H,9-15H2,1-3H3