2-[4-[(Z)-N-(1,3-benzothiazol-2-ylamino)-C-methyl-carbonimidoyl]phenoxy]ethanoate

Systemtic Name: 2-[4-[(Z)-N-(1,3-benzothiazol-2-ylamino)-C-methyl-carbonimidoyl]phenoxy]ethanoate Openeye Name: 2-[4-[(Z)-N-(1,3-benzothiazol-2-ylamino)-C-methyl-carbonimidoyl]phenoxy]acetate CAS Name: 2-[4-[(1Z)-1-(1,3-benzothiazol-2-ylhydrazinylidene)ethyl]phenoxy]acetate IUPAC Name: 2-[4-[(Z)-N-(1,3-benzothiazol-2-ylamino)-C-methylcarbonimidoyl]phenoxy]acetate Traditional Name: 2-[4-[(Z)-N-(1,3-benzothiazol-2-ylamino)-C-methyl-carbonimidoyl]phenoxy]acetate Formula: C17H14N3O3S- MolecularWeight: 340.37636

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC1=NC2=CC=CC=C2S1)C3=CC=C(C=C3)OCC(=O)[O-]

Isomeric SMILES

C/C(=N/NC1=NC2=CC=CC=C2S1)/C3=CC=C(C=C3)OCC(=O)[O-]

InChI

InChI=1S/C17H15N3O3S/c1-11(12-6-8-13(9-7-12)23-10-16(21)22)19-20-17-18-14-4-2-3-5-15(14)24-17/h2-9H,10H2,1H3,(H,18,20)(H,21,22)/p-1/b19-11-