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1-[1,3-benzothiazol-2-yl-(4-methylphenyl)methyl]piperidine-2-carboxylic acid
1-[1,3-benzothiazol-2-yl-(4-methylphenyl)methyl]piperidine-2-carboxylic acid
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Descriptors Computed from Structure
Canonical SMILES:
CC1=CC=C(C=C1)C(C2=NC3=CC=CC=C3S2)N4CCCCC4C(=O)O
Isomeric SMILES
CC1=CC=C(C=C1)C(C2=NC3=CC=CC=C3S2)N4CCCCC4C(=O)O
InChI
InChI=1S/C21H22N2O2S/c1-14-9-11-15(12-10-14)19(23-13-5-4-7-17(23)21(24)25)20-22-16-6-2-3-8-18(16)26-20/h2-3,6,8-12,17,19H,4-5,7,13H2,1H3,(H,24,25)
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