sodium 4-methoxy-4-oxidanylidene-3-(prop-1-en-2-ylamino)-2-thiophen-3-yl-butanoate

Systemtic Name: sodium 4-methoxy-4-oxidanylidene-3-(prop-1-en-2-ylamino)-2-thiophen-3-yl-butanoate Openeye Name: sodium 3-(isopropenylamino)-4-methoxy-4-oxo-2-(3-thienyl)butanoate CAS Name: sodium 4-methoxy-3-(1-methylethenylamino)-4-oxo-2-(3-thiophenyl)butanoate IUPAC Name: sodium 4-methoxy-4-oxo-3-(prop-1-en-2-ylamino)-2-thiophen-3-ylbutanoate Traditional Name: sodium 3-(isopropenylamino)-4-keto-4-methoxy-2-(3-thienyl)butyrate Formula: C12H14NNaO4S MolecularWeight: 291.29863

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=C)NC(C(C1=CSC=C1)C(=O)[O-])C(=O)OC.[Na+]

Isomeric SMILES

CC(=C)NC(C(C1=CSC=C1)C(=O)[O-])C(=O)OC.[Na+]

InChI

InChI=1S/C12H15NO4S.Na/c1-7(2)13-10(12(16)17-3)9(11(14)15)8-4-5-18-6-8;/h4-6,9-10,13H,1H2,2-3H3,(H,14,15);/q;+1/p-1