ethyl 1-[2-[(6-chloranyl-3-oxidanylidene-4H-1,4-benzoxazin-7-yl)sulfonyl-methyl-amino]ethanoyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[2-[(6-chloranyl-3-oxidanylidene-4H-1,4-benzoxazin-7-yl)sulfonyl-methyl-amino]ethanoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[2-[(6-chloro-3-oxo-4H-1,4-benzoxazin-7-yl)sulfonyl-methyl-amino]acetyl]piperidine-4-carboxylate CAS Name: 1-[2-[(6-chloro-3-oxo-4H-1,4-benzoxazin-7-yl)sulfonyl-methylamino]-1-oxoethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-[(6-chloro-3-oxo-4H-1,4-benzoxazin-7-yl)sulfonyl-methylamino]acetyl]piperidine-4-carboxylate Traditional Name: 1-[2-[(6-chloro-3-keto-4H-1,4-benzoxazin-7-yl)sulfonyl-methyl-amino]acetyl]isonipecotic acid ethyl ester Formula: C19H24ClN3O7S MolecularWeight: 473.92776

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)CN(C)S(=O)(=O)C2=C(C=C3C(=C2)OCC(=O)N3)Cl

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)CN(C)S(=O)(=O)C2=C(C=C3C(=C2)OCC(=O)N3)Cl

InChI

InChI=1S/C19H24ClN3O7S/c1-3-29-19(26)12-4-6-23(7-5-12)18(25)10-22(2)31(27,28)16-9-15-14(8-13(16)20)21-17(24)11-30-15/h8-9,12H,3-7,10-11H2,1-2H3,(H,21,24)