4-[(1,3-benzothiazol-2-ylamino)methyl]benzoic acid

Systemtic Name: 4-[(1,3-benzothiazol-2-ylamino)methyl]benzoic acid Openeye Name: 4-[(1,3-benzothiazol-2-ylamino)methyl]benzoic acid CAS Name: 4-[(1,3-benzothiazol-2-ylamino)methyl]benzoic acid IUPAC Name: 4-[(1,3-benzothiazol-2-ylamino)methyl]benzoic acid Traditional Name: 4-[(1,3-benzothiazol-2-ylamino)methyl]benzoic acid Formula: C15H12N2O2S MolecularWeight: 284.33298

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)NCC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)NCC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C15H12N2O2S/c18-14(19)11-7-5-10(6-8-11)9-16-15-17-12-3-1-2-4-13(12)20-15/h1-8H,9H2,(H,16,17)(H,18,19)