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

Systemtic Name: 6-[(6-ethoxy-1,3-benzothiazol-2-yl)amino]-6-oxidanylidene-hexanoic acid Openeye Name: 6-[(6-ethoxy-1,3-benzothiazol-2-yl)amino]-6-oxo-hexanoic acid CAS Name: 6-[(6-ethoxy-1,3-benzothiazol-2-yl)amino]-6-oxohexanoic acid IUPAC Name: 6-[(6-ethoxy-1,3-benzothiazol-2-yl)amino]-6-oxohexanoic acid Traditional Name: 6-[(6-ethoxy-1,3-benzothiazol-2-yl)amino]-6-keto-hexanoic acid Formula: C15H18N2O4S MolecularWeight: 322.37942

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)CCCCC(=O)O

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)CCCCC(=O)O

InChI

InChI=1S/C15H18N2O4S/c1-2-21-10-7-8-11-12(9-10)22-15(16-11)17-13(18)5-3-4-6-14(19)20/h7-9H,2-6H2,1H3,(H,19,20)(H,16,17,18)