1-[5-(2-methylindol-1-yl)thiophen-2-yl]carbonylpiperidine-4-carboxylic acid

Systemtic Name: 1-[5-(2-methylindol-1-yl)thiophen-2-yl]carbonylpiperidine-4-carboxylic acid Openeye Name: 1-[5-(2-methylindol-1-yl)thiophene-2-carbonyl]piperidine-4-carboxylic acid CAS Name: 1-[[5-(2-methyl-1-indolyl)-2-thiophenyl]-oxomethyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[5-(2-methylindol-1-yl)thiophene-2-carbonyl]piperidine-4-carboxylic acid Traditional Name: 1-[5-(2-methylindol-1-yl)thiophene-2-carbonyl]isonipecotic acid Formula: C20H20N2O3S MolecularWeight: 368.4494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=CC=CC=C2N1C3=CC=C(S3)C(=O)N4CCC(CC4)C(=O)O

Isomeric SMILES

CC1=CC2=CC=CC=C2N1C3=CC=C(S3)C(=O)N4CCC(CC4)C(=O)O

InChI

InChI=1S/C20H20N2O3S/c1-13-12-15-4-2-3-5-16(15)22(13)18-7-6-17(26-18)19(23)21-10-8-14(9-11-21)20(24)25/h2-7,12,14H,8-11H2,1H3,(H,24,25)