4-oxidanylidene-4-[propan-2-yl(thiophen-2-ylmethyl)amino]butanoate

Systemtic Name: 4-oxidanylidene-4-[propan-2-yl(thiophen-2-ylmethyl)amino]butanoate Openeye Name: 4-[isopropyl(2-thienylmethyl)amino]-4-oxo-butanoate CAS Name: 4-oxo-4-[propan-2-yl(thiophen-2-ylmethyl)amino]butanoate IUPAC Name: 4-oxo-4-[propan-2-yl(thiophen-2-ylmethyl)amino]butanoate Traditional Name: 4-[isopropyl(2-thenyl)amino]-4-keto-butyrate Formula: C12H16NO3S- MolecularWeight: 254.32534

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CC1=CC=CS1)C(=O)CCC(=O)[O-]

Isomeric SMILES

CC(C)N(CC1=CC=CS1)C(=O)CCC(=O)[O-]

InChI

InChI=1S/C12H17NO3S/c1-9(2)13(8-10-4-3-7-17-10)11(14)5-6-12(15)16/h3-4,7,9H,5-6,8H2,1-2H3,(H,15,16)/p-1