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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C(C2=CC(=C(C=C2)Cl)Cl)N3CCCCC3C(=O)O

Isomeric SMILES

CC1=C(SC=C1)C(C2=CC(=C(C=C2)Cl)Cl)N3CCCCC3C(=O)O

InChI

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