tert-butyl 3-[(3-methoxyphenyl)methyl]-2-oxidanyl-5-oxidanylidene-4-(phenylmethyl)piperazine-1-carboxylate

Systemtic Name: tert-butyl 3-[(3-methoxyphenyl)methyl]-2-oxidanyl-5-oxidanylidene-4-(phenylmethyl)piperazine-1-carboxylate Openeye Name: tert-butyl 4-benzyl-2-hydroxy-3-[(3-methoxyphenyl)methyl]-5-oxo-piperazine-1-carboxylate CAS Name: 2-hydroxy-3-[(3-methoxyphenyl)methyl]-5-oxo-4-(phenylmethyl)-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-benzyl-2-hydroxy-3-[(3-methoxyphenyl)methyl]-5-oxopiperazine-1-carboxylate Traditional Name: 4-benzyl-2-hydroxy-5-keto-3-m-anisyl-piperazine-1-carboxylic acid tert-butyl ester Formula: C24H30N2O5 MolecularWeight: 426.5054

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CC(=O)N(C(C1O)CC2=CC(=CC=C2)OC)CC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)N1CC(=O)N(C(C1O)CC2=CC(=CC=C2)OC)CC3=CC=CC=C3

InChI

InChI=1S/C24H30N2O5/c1-24(2,3)31-23(29)26-16-21(27)25(15-17-9-6-5-7-10-17)20(22(26)28)14-18-11-8-12-19(13-18)30-4/h5-13,20,22,28H,14-16H2,1-4H3