4-[1-[(5-chloranylthiophen-2-yl)methyl]-5-methoxy-indol-3-yl]piperidine-1-carboxylic acid

Systemtic Name: 4-[1-[(5-chloranylthiophen-2-yl)methyl]-5-methoxy-indol-3-yl]piperidine-1-carboxylic acid Openeye Name: 4-[1-[(5-chloro-2-thienyl)methyl]-5-methoxy-indol-3-yl]piperidine-1-carboxylic acid CAS Name: 4-[1-[(5-chloro-2-thiophenyl)methyl]-5-methoxy-3-indolyl]-1-piperidinecarboxylic acid IUPAC Name: 4-[1-[(5-chlorothiophen-2-yl)methyl]-5-methoxyindol-3-yl]piperidine-1-carboxylic acid Traditional Name: 4-[1-[(5-chloro-2-thienyl)methyl]-5-methoxy-indol-3-yl]piperidine-1-carboxylic acid Formula: C20H21ClN2O3S MolecularWeight: 404.91034

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N(C=C2C3CCN(CC3)C(=O)O)CC4=CC=C(S4)Cl

Isomeric SMILES

COC1=CC2=C(C=C1)N(C=C2C3CCN(CC3)C(=O)O)CC4=CC=C(S4)Cl

InChI

InChI=1S/C20H21ClN2O3S/c1-26-14-2-4-18-16(10-14)17(13-6-8-22(9-7-13)20(24)25)12-23(18)11-15-3-5-19(21)27-15/h2-5,10,12-13H,6-9,11H2,1H3,(H,24,25)