methyl 4-methyl-3-(3-thiophen-3-ylpropanoylamino)benzoate

Systemtic Name: methyl 4-methyl-3-(3-thiophen-3-ylpropanoylamino)benzoate Openeye Name: methyl 4-methyl-3-[3-(3-thienyl)propanoylamino]benzoate CAS Name: 4-methyl-3-[[1-oxo-3-(3-thiophenyl)propyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-methyl-3-(3-thiophen-3-ylpropanoylamino)benzoate Traditional Name: 4-methyl-3-[3-(3-thienyl)propanoylamino]benzoic acid methyl ester Formula: C16H17NO3S MolecularWeight: 303.37608

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CCC2=CSC=C2

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CCC2=CSC=C2

InChI

InChI=1S/C16H17NO3S/c1-11-3-5-13(16(19)20-2)9-14(11)17-15(18)6-4-12-7-8-21-10-12/h3,5,7-10H,4,6H2,1-2H3,(H,17,18)