ethyl 4-[(6-methyl-3-oxidanylidene-4H-1,4-benzoxazin-7-yl)sulfonyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[(6-methyl-3-oxidanylidene-4H-1,4-benzoxazin-7-yl)sulfonyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[(6-methyl-3-oxo-4H-1,4-benzoxazin-7-yl)sulfonyl]piperazine-1-carboxylate CAS Name: 4-[(6-methyl-3-oxo-4H-1,4-benzoxazin-7-yl)sulfonyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(6-methyl-3-oxo-4H-1,4-benzoxazin-7-yl)sulfonyl]piperazine-1-carboxylate Traditional Name: 4-[(3-keto-6-methyl-4H-1,4-benzoxazin-7-yl)sulfonyl]piperazine-1-carboxylic acid ethyl ester Formula: C16H21N3O6S MolecularWeight: 383.41944

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2C)NC(=O)CO3

Isomeric SMILES

CCOC(=O)N1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2C)NC(=O)CO3

InChI

InChI=1S/C16H21N3O6S/c1-3-24-16(21)18-4-6-19(7-5-18)26(22,23)14-9-13-12(8-11(14)2)17-15(20)10-25-13/h8-9H,3-7,10H2,1-2H3,(H,17,20)