5-[[4-(1,3-benzothiazol-2-ylmethoxy)phenyl]amino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-[[4-(1,3-benzothiazol-2-ylmethoxy)phenyl]amino]-5-oxidanylidene-pentanoic acid Openeye Name: 5-[4-(1,3-benzothiazol-2-ylmethoxy)anilino]-5-oxo-pentanoic acid CAS Name: 5-[4-(1,3-benzothiazol-2-ylmethoxy)anilino]-5-oxopentanoic acid IUPAC Name: 5-[4-(1,3-benzothiazol-2-ylmethoxy)anilino]-5-oxopentanoic acid Traditional Name: 5-[4-(1,3-benzothiazol-2-ylmethoxy)anilino]-5-keto-valeric acid Formula: C19H18N2O4S MolecularWeight: 370.42222

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)COC3=CC=C(C=C3)NC(=O)CCCC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)COC3=CC=C(C=C3)NC(=O)CCCC(=O)O

InChI

InChI=1S/C19H18N2O4S/c22-17(6-3-7-19(23)24)20-13-8-10-14(11-9-13)25-12-18-21-15-4-1-2-5-16(15)26-18/h1-2,4-5,8-11H,3,6-7,12H2,(H,20,22)(H,23,24)