dimethyl 2-(3,4-dihydro-2H-1,4-benzothiazin-7-ylcarbonylamino)hexanedioate

Systemtic Name: dimethyl 2-(3,4-dihydro-2H-1,4-benzothiazin-7-ylcarbonylamino)hexanedioate Openeye Name: dimethyl 2-(3,4-dihydro-2H-1,4-benzothiazine-7-carbonylamino)hexanedioate CAS Name: 2-[[3,4-dihydro-2H-1,4-benzothiazin-7-yl(oxo)methyl]amino]hexanedioic acid dimethyl ester IUPAC Name: dimethyl 2-(3,4-dihydro-2H-1,4-benzothiazine-7-carbonylamino)hexanedioate Traditional Name: 2-(3,4-dihydro-2H-1,4-benzothiazine-7-carbonylamino)adipic acid dimethyl ester Formula: C17H22N2O5S MolecularWeight: 366.43198

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCC(C(=O)OC)NC(=O)C1=CC2=C(C=C1)NCCS2

Isomeric SMILES

COC(=O)CCCC(C(=O)OC)NC(=O)C1=CC2=C(C=C1)NCCS2

InChI

InChI=1S/C17H22N2O5S/c1-23-15(20)5-3-4-13(17(22)24-2)19-16(21)11-6-7-12-14(10-11)25-9-8-18-12/h6-7,10,13,18H,3-5,8-9H2,1-2H3,(H,19,21)