5-[3-(3-chlorophenyl)-3-(propylamino)propyl]thiophene-2-carboxylic acid

Systemtic Name: 5-[3-(3-chlorophenyl)-3-(propylamino)propyl]thiophene-2-carboxylic acid Openeye Name: 5-[3-(3-chlorophenyl)-3-(propylamino)propyl]thiophene-2-carboxylic acid CAS Name: 5-[3-(3-chlorophenyl)-3-(propylamino)propyl]-2-thiophenecarboxylic acid IUPAC Name: 5-[3-(3-chlorophenyl)-3-(propylamino)propyl]thiophene-2-carboxylic acid Traditional Name: 5-[3-(3-chlorophenyl)-3-(propylamino)propyl]-2-thenoic acid Formula: C17H20ClNO2S MolecularWeight: 337.8642

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(CCC1=CC=C(S1)C(=O)O)C2=CC(=CC=C2)Cl

Isomeric SMILES

CCCNC(CCC1=CC=C(S1)C(=O)O)C2=CC(=CC=C2)Cl

InChI

InChI=1S/C17H20ClNO2S/c1-2-10-19-15(12-4-3-5-13(18)11-12)8-6-14-7-9-16(22-14)17(20)21/h3-5,7,9,11,15,19H,2,6,8,10H2,1H3,(H,20,21)