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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=C1)C(C2=CC=CC=C2OC)N3CCC(CC3)C(=O)O

Isomeric SMILES

CC1=CSC(=C1)C(C2=CC=CC=C2OC)N3CCC(CC3)C(=O)O

InChI

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