5-(3-cyano-4-piperidin-1-yl-phenyl)thiophene-2-carboxylic acid

Systemtic Name: 5-(3-cyano-4-piperidin-1-yl-phenyl)thiophene-2-carboxylic acid Openeye Name: 5-[3-cyano-4-(1-piperidyl)phenyl]thiophene-2-carboxylic acid CAS Name: 5-[3-cyano-4-(1-piperidinyl)phenyl]-2-thiophenecarboxylic acid IUPAC Name: 5-(3-cyano-4-piperidin-1-ylphenyl)thiophene-2-carboxylic acid Traditional Name: 5-(3-cyano-4-piperidino-phenyl)-2-thenoic acid Formula: C17H16N2O2S MolecularWeight: 312.38614

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)C3=CC=C(S3)C(=O)O)C#N

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)C3=CC=C(S3)C(=O)O)C#N

InChI

InChI=1S/C17H16N2O2S/c18-11-13-10-12(15-6-7-16(22-15)17(20)21)4-5-14(13)19-8-2-1-3-9-19/h4-7,10H,1-3,8-9H2,(H,20,21)