sodium 6-ethyl-5-(4-methylthiophen-2-yl)carbonyl-2,3-dihydro-1H-pyrrolizine-1-carboxylate

Systemtic Name: sodium 6-ethyl-5-(4-methylthiophen-2-yl)carbonyl-2,3-dihydro-1H-pyrrolizine-1-carboxylate Openeye Name: sodium 6-ethyl-5-(4-methylthiophene-2-carbonyl)-2,3-dihydro-1H-pyrrolizine-1-carboxylate CAS Name: sodium 6-ethyl-5-[(4-methyl-2-thiophenyl)-oxomethyl]-2,3-dihydro-1H-pyrrolizine-1-carboxylate IUPAC Name: sodium 6-ethyl-5-(4-methylthiophene-2-carbonyl)-2,3-dihydro-1H-pyrrolizine-1-carboxylate Traditional Name: sodium 6-ethyl-5-(4-methylthiophene-2-carbonyl)-2,3-dihydro-1H-pyrrolizine-1-carboxylate Formula: C16H16NNaO3S MolecularWeight: 325.35791

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N2CCC(C2=C1)C(=O)[O-])C(=O)C3=CC(=CS3)C.[Na+]

Isomeric SMILES

CCC1=C(N2CCC(C2=C1)C(=O)[O-])C(=O)C3=CC(=CS3)C.[Na+]

InChI

InChI=1S/C16H17NO3S.Na/c1-3-10-7-12-11(16(19)20)4-5-17(12)14(10)15(18)13-6-9(2)8-21-13;/h6-8,11H,3-5H2,1-2H3,(H,19,20);/q;+1/p-1