sodium 3-azanyl-3-methoxycarbonyl-4-methyl-2-thiophen-3-yl-pent-4-enoate

Systemtic Name: sodium 3-azanyl-3-methoxycarbonyl-4-methyl-2-thiophen-3-yl-pent-4-enoate Openeye Name: sodium 3-amino-3-methoxycarbonyl-4-methyl-2-(3-thienyl)pent-4-enoate CAS Name: sodium 3-amino-3-methoxycarbonyl-4-methyl-2-(3-thiophenyl)-4-pentenoate IUPAC Name: sodium 3-amino-3-methoxycarbonyl-4-methyl-2-thiophen-3-ylpent-4-enoate Traditional Name: sodium 3-amino-3-carbomethoxy-4-methyl-2-(3-thienyl)pent-4-enoate Formula: C12H14NNaO4S MolecularWeight: 291.29863

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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