methyl 3-(3-methylbutylamino)-3-thiophen-2-yl-propanoate

Systemtic Name: methyl 3-(3-methylbutylamino)-3-thiophen-2-yl-propanoate Openeye Name: methyl 3-(isopentylamino)-3-(2-thienyl)propanoate CAS Name: 3-(3-methylbutylamino)-3-thiophen-2-ylpropanoic acid methyl ester IUPAC Name: methyl 3-(3-methylbutylamino)-3-thiophen-2-ylpropanoate Traditional Name: 3-(isoamylamino)-3-(2-thienyl)propionic acid methyl ester Formula: C13H21NO2S MolecularWeight: 255.37634

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(CC(=O)OC)C1=CC=CS1

Isomeric SMILES

CC(C)CCNC(CC(=O)OC)C1=CC=CS1

InChI

InChI=1S/C13H21NO2S/c1-10(2)6-7-14-11(9-13(15)16-3)12-5-4-8-17-12/h4-5,8,10-11,14H,6-7,9H2,1-3H3