[3-(methoxycarbonylamino)-1H-2,1,4-benzothiadiazin-7-yl] 4-propan-2-yloxybenzenesulfonate

Systemtic Name: [3-(methoxycarbonylamino)-1H-2,1,4-benzothiadiazin-7-yl] 4-propan-2-yloxybenzenesulfonate Openeye Name: [3-(methoxycarbonylamino)-1H-2,1,4-benzothiadiazin-7-yl] 4-isopropoxybenzenesulfonate CAS Name: 4-propan-2-yloxybenzenesulfonic acid [3-(methoxycarbonylamino)-1H-2,1,4-benzothiadiazin-7-yl] ester IUPAC Name: [3-(methoxycarbonylamino)-1H-2,1,4-benzothiadiazin-7-yl] 4-propan-2-yloxybenzenesulfonate Traditional Name: 4-isopropoxybenzenesulfonic acid [3-(carbomethoxyamino)-1H-2,1,4-benzothiadiazin-7-yl] ester Formula: C18H19N3O6S2 MolecularWeight: 437.48996

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)S(=O)(=O)OC2=CC3=C(C=C2)N=C(SN3)NC(=O)OC

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)S(=O)(=O)OC2=CC3=C(C=C2)N=C(SN3)NC(=O)OC

InChI

InChI=1S/C18H19N3O6S2/c1-11(2)26-12-4-7-14(8-5-12)29(23,24)27-13-6-9-15-16(10-13)21-28-17(19-15)20-18(22)25-3/h4-11,21H,1-3H3,(H,19,20,22)