ethyl 4-[(3-oxidanylidene-4H-1,4-benzoxazin-7-yl)sulfonyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[(3-oxidanylidene-4H-1,4-benzoxazin-7-yl)sulfonyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[(3-oxo-4H-1,4-benzoxazin-7-yl)sulfonyl]piperazine-1-carboxylate CAS Name: 4-[(3-oxo-4H-1,4-benzoxazin-7-yl)sulfonyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(3-oxo-4H-1,4-benzoxazin-7-yl)sulfonyl]piperazine-1-carboxylate Traditional Name: 4-[(3-keto-4H-1,4-benzoxazin-7-yl)sulfonyl]piperazine-1-carboxylic acid ethyl ester Formula: C15H19N3O6S MolecularWeight: 369.39286

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)NC(=O)CO3

Isomeric SMILES

CCOC(=O)N1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)NC(=O)CO3

InChI

InChI=1S/C15H19N3O6S/c1-2-23-15(20)17-5-7-18(8-6-17)25(21,22)11-3-4-12-13(9-11)24-10-14(19)16-12/h3-4,9H,2,5-8,10H2,1H3,(H,16,19)