1-[(4-acetamidophenyl)-(4-methyl-1,3-thiazol-2-yl)methyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[(4-acetamidophenyl)-(4-methyl-1,3-thiazol-2-yl)methyl]piperidine-4-carboxylic acid Openeye Name: 1-[(4-acetamidophenyl)-(4-methylthiazol-2-yl)methyl]piperidine-4-carboxylic acid CAS Name: 1-[(4-acetamidophenyl)-(4-methyl-2-thiazolyl)methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[(4-acetamidophenyl)-(4-methyl-1,3-thiazol-2-yl)methyl]piperidine-4-carboxylic acid Traditional Name: 1-[(4-acetamidophenyl)-(4-methylthiazol-2-yl)methyl]isonipecotic acid Formula: C19H23N3O3S MolecularWeight: 373.46922

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)C(C2=CC=C(C=C2)NC(=O)C)N3CCC(CC3)C(=O)O

Isomeric SMILES

CC1=CSC(=N1)C(C2=CC=C(C=C2)NC(=O)C)N3CCC(CC3)C(=O)O

InChI

InChI=1S/C19H23N3O3S/c1-12-11-26-18(20-12)17(22-9-7-15(8-10-22)19(24)25)14-3-5-16(6-4-14)21-13(2)23/h3-6,11,15,17H,7-10H2,1-2H3,(H,21,23)(H,24,25)