[3-(methylcarbamoyl)-2-(3-thiophen-2-ylpropyl)phenyl] benzoate

Systemtic Name: [3-(methylcarbamoyl)-2-(3-thiophen-2-ylpropyl)phenyl] benzoate Openeye Name: [3-(methylcarbamoyl)-2-[3-(2-thienyl)propyl]phenyl] benzoate CAS Name: benzoic acid [3-(methylcarbamoyl)-2-(3-thiophen-2-ylpropyl)phenyl] ester IUPAC Name: [3-(methylcarbamoyl)-2-(3-thiophen-2-ylpropyl)phenyl] benzoate Traditional Name: benzoic acid [3-(methylcarbamoyl)-2-[3-(2-thienyl)propyl]phenyl] ester Formula: C22H21NO3S MolecularWeight: 379.47204

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=C(C(=CC=C1)OC(=O)C2=CC=CC=C2)CCCC3=CC=CS3

Isomeric SMILES

CNC(=O)C1=C(C(=CC=C1)OC(=O)C2=CC=CC=C2)CCCC3=CC=CS3

InChI

InChI=1S/C22H21NO3S/c1-23-21(24)19-13-6-14-20(26-22(25)16-8-3-2-4-9-16)18(19)12-5-10-17-11-7-15-27-17/h2-4,6-9,11,13-15H,5,10,12H2,1H3,(H,23,24)