methyl 3-methyl-2-(thiophen-3-ylmethylamino)pentanoate

Systemtic Name: methyl 3-methyl-2-(thiophen-3-ylmethylamino)pentanoate Openeye Name: methyl 3-methyl-2-(3-thienylmethylamino)pentanoate CAS Name: 3-methyl-2-(3-thiophenylmethylamino)pentanoic acid methyl ester IUPAC Name: methyl 3-methyl-2-(thiophen-3-ylmethylamino)pentanoate Traditional Name: 3-methyl-2-(3-thenylamino)valeric acid methyl ester Formula: C12H19NO2S MolecularWeight: 241.34976

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)OC)NCC1=CSC=C1

Isomeric SMILES

CCC(C)C(C(=O)OC)NCC1=CSC=C1

InChI

InChI=1S/C12H19NO2S/c1-4-9(2)11(12(14)15-3)13-7-10-5-6-16-8-10/h5-6,8-9,11,13H,4,7H2,1-3H3