tert-butyl 4-(4-oxidanylidene-3,1-benzoxazin-2-yl)piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-(4-oxidanylidene-3,1-benzoxazin-2-yl)piperazine-1-carboxylate Openeye Name: tert-butyl 4-(4-oxo-3,1-benzoxazin-2-yl)piperazine-1-carboxylate CAS Name: 4-(4-oxo-3,1-benzoxazin-2-yl)-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(4-oxo-3,1-benzoxazin-2-yl)piperazine-1-carboxylate Traditional Name: 4-(4-keto-3,1-benzoxazin-2-yl)piperazine-1-carboxylic acid tert-butyl ester Formula: C17H21N3O4 MolecularWeight: 331.36634

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C2=NC3=CC=CC=C3C(=O)O2

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C2=NC3=CC=CC=C3C(=O)O2

InChI

InChI=1S/C17H21N3O4/c1-17(2,3)24-16(22)20-10-8-19(9-11-20)15-18-13-7-5-4-6-12(13)14(21)23-15/h4-7H,8-11H2,1-3H3