(6-methoxycarbonyl-3-oxidanylidene-4H-1,4-benzothiazin-2-yl)-bis(2-methylpropyl)azanium

Systemtic Name: (6-methoxycarbonyl-3-oxidanylidene-4H-1,4-benzothiazin-2-yl)-bis(2-methylpropyl)azanium Openeye Name: diisobutyl-(6-methoxycarbonyl-3-oxo-4H-1,4-benzothiazin-2-yl)ammonium CAS Name: (6-methoxycarbonyl-3-oxo-4H-1,4-benzothiazin-2-yl)-bis(2-methylpropyl)ammonium IUPAC Name: (6-methoxycarbonyl-3-oxo-4H-1,4-benzothiazin-2-yl)-bis(2-methylpropyl)azanium Traditional Name: (6-carbomethoxy-3-keto-4H-1,4-benzothiazin-2-yl)-diisobutyl-ammonium Formula: C18H27N2O3S+ MolecularWeight: 351.48358

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C[NH+](CC(C)C)C1C(=O)NC2=C(S1)C=CC(=C2)C(=O)OC

Isomeric SMILES

CC(C)C[NH+](CC(C)C)C1C(=O)NC2=C(S1)C=CC(=C2)C(=O)OC

InChI

InChI=1S/C18H26N2O3S/c1-11(2)9-20(10-12(3)4)17-16(21)19-14-8-13(18(22)23-5)6-7-15(14)24-17/h6-8,11-12,17H,9-10H2,1-5H3,(H,19,21)/p+1