tert-butyl (3Z)-2-acetyloxy-3-[(3-methoxyphenyl)methylidene]-5-oxidanylidene-4-(phenylmethyl)piperazine-1-carboxylate

Systemtic Name: tert-butyl (3Z)-2-acetyloxy-3-[(3-methoxyphenyl)methylidene]-5-oxidanylidene-4-(phenylmethyl)piperazine-1-carboxylate Openeye Name: tert-butyl (3Z)-2-acetoxy-4-benzyl-3-[(3-methoxyphenyl)methylene]-5-oxo-piperazine-1-carboxylate CAS Name: (3Z)-2-acetyloxy-3-[(3-methoxyphenyl)methylidene]-5-oxo-4-(phenylmethyl)-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (3Z)-2-acetyloxy-4-benzyl-3-[(3-methoxyphenyl)methylidene]-5-oxopiperazine-1-carboxylate Traditional Name: (3Z)-2-acetoxy-4-benzyl-5-keto-3-m-anisylidene-piperazine-1-carboxylic acid tert-butyl ester Formula: C26H30N2O6 MolecularWeight: 466.5262

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1C(=CC2=CC(=CC=C2)OC)N(C(=O)CN1C(=O)OC(C)(C)C)CC3=CC=CC=C3

Isomeric SMILES

CC(=O)OC1/C(=C/C2=CC(=CC=C2)OC)/N(C(=O)CN1C(=O)OC(C)(C)C)CC3=CC=CC=C3

InChI

InChI=1S/C26H30N2O6/c1-18(29)33-24-22(15-20-12-9-13-21(14-20)32-5)27(16-19-10-7-6-8-11-19)23(30)17-28(24)25(31)34-26(2,3)4/h6-15,24H,16-17H2,1-5H3/b22-15-