6-[(6-methyl-1,3-benzothiazol-2-yl)amino]-6-oxidanylidene-hexanoic acid

Systemtic Name: 6-[(6-methyl-1,3-benzothiazol-2-yl)amino]-6-oxidanylidene-hexanoic acid Openeye Name: 6-[(6-methyl-1,3-benzothiazol-2-yl)amino]-6-oxo-hexanoic acid CAS Name: 6-[(6-methyl-1,3-benzothiazol-2-yl)amino]-6-oxohexanoic acid IUPAC Name: 6-[(6-methyl-1,3-benzothiazol-2-yl)amino]-6-oxohexanoic acid Traditional Name: 6-keto-6-[(6-methyl-1,3-benzothiazol-2-yl)amino]hexanoic acid Formula: C14H16N2O3S MolecularWeight: 292.35344

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)NC(=O)CCCCC(=O)O

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)NC(=O)CCCCC(=O)O

InChI

InChI=1S/C14H16N2O3S/c1-9-6-7-10-11(8-9)20-14(15-10)16-12(17)4-2-3-5-13(18)19/h6-8H,2-5H2,1H3,(H,18,19)(H,15,16,17)