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

Systemtic Name: ethyl 4-[3-[(6-chloranyl-3-oxidanylidene-4H-1,4-benzoxazin-7-yl)sulfonyl]propanoylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[3-[(6-chloro-3-oxo-4H-1,4-benzoxazin-7-yl)sulfonyl]propanoylamino]piperidine-1-carboxylate CAS Name: 4-[[3-[(6-chloro-3-oxo-4H-1,4-benzoxazin-7-yl)sulfonyl]-1-oxopropyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[3-[(6-chloro-3-oxo-4H-1,4-benzoxazin-7-yl)sulfonyl]propanoylamino]piperidine-1-carboxylate Traditional Name: 4-[3-[(6-chloro-3-keto-4H-1,4-benzoxazin-7-yl)sulfonyl]propanoylamino]piperidine-1-carboxylic acid ethyl ester Formula: C19H24ClN3O7S MolecularWeight: 473.92776

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)CCS(=O)(=O)C2=C(C=C3C(=C2)OCC(=O)N3)Cl

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=O)CCS(=O)(=O)C2=C(C=C3C(=C2)OCC(=O)N3)Cl

InChI

InChI=1S/C19H24ClN3O7S/c1-2-29-19(26)23-6-3-12(4-7-23)21-17(24)5-8-31(27,28)16-10-15-14(9-13(16)20)22-18(25)11-30-15/h9-10,12H,2-8,11H2,1H3,(H,21,24)(H,22,25)