1-[(5-chloranylthiophen-2-yl)-(3-methoxyphenyl)methyl]piperidine-2-carboxylic acid

Systemtic Name: 1-[(5-chloranylthiophen-2-yl)-(3-methoxyphenyl)methyl]piperidine-2-carboxylic acid Openeye Name: 1-[(5-chloro-2-thienyl)-(3-methoxyphenyl)methyl]piperidine-2-carboxylic acid CAS Name: 1-[(5-chloro-2-thiophenyl)-(3-methoxyphenyl)methyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[(5-chlorothiophen-2-yl)-(3-methoxyphenyl)methyl]piperidine-2-carboxylic acid Traditional Name: 1-[(5-chloro-2-thienyl)-(3-methoxyphenyl)methyl]pipecolinic acid Formula: C18H20ClNO3S MolecularWeight: 365.8743

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(C2=CC=C(S2)Cl)N3CCCCC3C(=O)O

Isomeric SMILES

COC1=CC=CC(=C1)C(C2=CC=C(S2)Cl)N3CCCCC3C(=O)O

InChI

InChI=1S/C18H20ClNO3S/c1-23-13-6-4-5-12(11-13)17(15-8-9-16(19)24-15)20-10-3-2-7-14(20)18(21)22/h4-6,8-9,11,14,17H,2-3,7,10H2,1H3,(H,21,22)