methyl 3-[2-(3-phenylpropanoylamino)phenoxy]thiophene-2-carboxylate

Systemtic Name: methyl 3-[2-(3-phenylpropanoylamino)phenoxy]thiophene-2-carboxylate Openeye Name: methyl 3-[2-(3-phenylpropanoylamino)phenoxy]thiophene-2-carboxylate CAS Name: 3-[2-[(1-oxo-3-phenylpropyl)amino]phenoxy]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[2-(3-phenylpropanoylamino)phenoxy]thiophene-2-carboxylate Traditional Name: 3-[2-(hydrocinnamoylamino)phenoxy]thiophene-2-carboxylic acid methyl ester Formula: C21H19NO4S MolecularWeight: 381.44486

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CS1)OC2=CC=CC=C2NC(=O)CCC3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=C(C=CS1)OC2=CC=CC=C2NC(=O)CCC3=CC=CC=C3

InChI

InChI=1S/C21H19NO4S/c1-25-21(24)20-18(13-14-27-20)26-17-10-6-5-9-16(17)22-19(23)12-11-15-7-3-2-4-8-15/h2-10,13-14H,11-12H2,1H3,(H,22,23)