1-[(4-methoxyphenyl)-(3-methylthiophen-2-yl)methyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[(4-methoxyphenyl)-(3-methylthiophen-2-yl)methyl]piperidine-4-carboxylic acid Openeye Name: 1-[(4-methoxyphenyl)-(3-methyl-2-thienyl)methyl]piperidine-4-carboxylic acid CAS Name: 1-[(4-methoxyphenyl)-(3-methyl-2-thiophenyl)methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[(4-methoxyphenyl)-(3-methylthiophen-2-yl)methyl]piperidine-4-carboxylic acid Traditional Name: 1-[(4-methoxyphenyl)-(3-methyl-2-thienyl)methyl]isonipecotic acid Formula: C19H23NO3S MolecularWeight: 345.45582

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C(C2=CC=C(C=C2)OC)N3CCC(CC3)C(=O)O

Isomeric SMILES

CC1=C(SC=C1)C(C2=CC=C(C=C2)OC)N3CCC(CC3)C(=O)O

InChI

InChI=1S/C19H23NO3S/c1-13-9-12-24-18(13)17(14-3-5-16(23-2)6-4-14)20-10-7-15(8-11-20)19(21)22/h3-6,9,12,15,17H,7-8,10-11H2,1-2H3,(H,21,22)