diethyl-[2-[[2-[(4-methoxycarbonylphenyl)carbonylamino]-1,3-benzothiazol-6-yl]carbonyloxy]ethyl]azanium

Systemtic Name: diethyl-[2-[[2-[(4-methoxycarbonylphenyl)carbonylamino]-1,3-benzothiazol-6-yl]carbonyloxy]ethyl]azanium Openeye Name: diethyl-[2-[2-[(4-methoxycarbonylbenzoyl)amino]-1,3-benzothiazole-6-carbonyl]oxyethyl]ammonium CAS Name: diethyl-[2-[[2-[[(4-methoxycarbonylphenyl)-oxomethyl]amino]-1,3-benzothiazol-6-yl]-oxomethoxy]ethyl]ammonium IUPAC Name: diethyl-[2-[2-[(4-methoxycarbonylbenzoyl)amino]-1,3-benzothiazole-6-carbonyl]oxyethyl]azanium Traditional Name: 2-[2-[(4-carbomethoxybenzoyl)amino]-1,3-benzothiazole-6-carbonyl]oxyethyl-diethyl-ammonium Formula: C23H26N3O5S+ MolecularWeight: 456.53464

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCOC(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CC[NH+](CC)CCOC(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C23H25N3O5S/c1-4-26(5-2)12-13-31-22(29)17-10-11-18-19(14-17)32-23(24-18)25-20(27)15-6-8-16(9-7-15)21(28)30-3/h6-11,14H,4-5,12-13H2,1-3H3,(H,24,25,27)/p+1