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

Systemtic Name: 1-[furan-2-yl-(3-methylthiophen-2-yl)methyl]piperidine-3-carboxylic acid Openeye Name: 1-[2-furyl-(3-methyl-2-thienyl)methyl]piperidine-3-carboxylic acid CAS Name: 1-[2-furanyl-(3-methyl-2-thiophenyl)methyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[furan-2-yl-(3-methylthiophen-2-yl)methyl]piperidine-3-carboxylic acid Traditional Name: 1-[2-furyl-(3-methyl-2-thienyl)methyl]nipecotic acid Formula: C16H19NO3S MolecularWeight: 305.39196

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C(C2=CC=CO2)N3CCCC(C3)C(=O)O

Isomeric SMILES

CC1=C(SC=C1)C(C2=CC=CO2)N3CCCC(C3)C(=O)O

InChI

InChI=1S/C16H19NO3S/c1-11-6-9-21-15(11)14(13-5-3-8-20-13)17-7-2-4-12(10-17)16(18)19/h3,5-6,8-9,12,14H,2,4,7,10H2,1H3,(H,18,19)