1-[(3,4-dichlorophenyl)-(5-methylthiophen-2-yl)methyl]piperidine-2-carboxylic acid

Systemtic Name: 1-[(3,4-dichlorophenyl)-(5-methylthiophen-2-yl)methyl]piperidine-2-carboxylic acid Openeye Name: 1-[(3,4-dichlorophenyl)-(5-methyl-2-thienyl)methyl]piperidine-2-carboxylic acid CAS Name: 1-[(3,4-dichlorophenyl)-(5-methyl-2-thiophenyl)methyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[(3,4-dichlorophenyl)-(5-methylthiophen-2-yl)methyl]piperidine-2-carboxylic acid Traditional Name: 1-[(3,4-dichlorophenyl)-(5-methyl-2-thienyl)methyl]pipecolinic acid Formula: C18H19Cl2NO2S MolecularWeight: 384.31996

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C(C2=CC(=C(C=C2)Cl)Cl)N3CCCCC3C(=O)O

Isomeric SMILES

CC1=CC=C(S1)C(C2=CC(=C(C=C2)Cl)Cl)N3CCCCC3C(=O)O

InChI

InChI=1S/C18H19Cl2NO2S/c1-11-5-8-16(24-11)17(12-6-7-13(19)14(20)10-12)21-9-3-2-4-15(21)18(22)23/h5-8,10,15,17H,2-4,9H2,1H3,(H,22,23)