5-[3-[3-(3-chlorophenyl)propyl-pyrrolidin-1-ylcarbonyl-amino]propyl]thiophene-2-carboxylic acid

Systemtic Name: 5-[3-[3-(3-chlorophenyl)propyl-pyrrolidin-1-ylcarbonyl-amino]propyl]thiophene-2-carboxylic acid Openeye Name: 5-[3-[3-(3-chlorophenyl)propyl-(pyrrolidine-1-carbonyl)amino]propyl]thiophene-2-carboxylic acid CAS Name: 5-[3-[3-(3-chlorophenyl)propyl-[oxo(1-pyrrolidinyl)methyl]amino]propyl]-2-thiophenecarboxylic acid IUPAC Name: 5-[3-[3-(3-chlorophenyl)propyl-(pyrrolidine-1-carbonyl)amino]propyl]thiophene-2-carboxylic acid Traditional Name: 5-[3-[3-(3-chlorophenyl)propyl-(pyrrolidine-1-carbonyl)amino]propyl]-2-thenoic acid Formula: C22H27ClN2O3S MolecularWeight: 434.97938

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)N(CCCC2=CC(=CC=C2)Cl)CCCC3=CC=C(S3)C(=O)O

Isomeric SMILES

C1CCN(C1)C(=O)N(CCCC2=CC(=CC=C2)Cl)CCCC3=CC=C(S3)C(=O)O

InChI

InChI=1S/C22H27ClN2O3S/c23-18-8-3-6-17(16-18)7-4-14-25(22(28)24-12-1-2-13-24)15-5-9-19-10-11-20(29-19)21(26)27/h3,6,8,10-11,16H,1-2,4-5,7,9,12-15H2,(H,26,27)