sodium 1-[(4-methoxyphenyl)methyl]-2-oxidanylidene-4-(phenylsulfonyl)-3H-pyrrol-5-olate

Systemtic Name: sodium 1-[(4-methoxyphenyl)methyl]-2-oxidanylidene-4-(phenylsulfonyl)-3H-pyrrol-5-olate Openeye Name: sodium 4-(benzenesulfonyl)-1-[(4-methoxyphenyl)methyl]-2-oxo-3H-pyrrol-5-olate CAS Name: sodium 4-(benzenesulfonyl)-1-[(4-methoxyphenyl)methyl]-2-oxo-3H-pyrrol-5-olate IUPAC Name: sodium 4-(benzenesulfonyl)-1-[(4-methoxyphenyl)methyl]-2-oxo-3H-pyrrol-5-olate Traditional Name: sodium 3-besyl-5-keto-1-p-anisyl-2-pyrrolin-2-olate Formula: C18H16NNaO5S MolecularWeight: 381.37811

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2C(=O)CC(=C2[O-])S(=O)(=O)C3=CC=CC=C3.[Na+]

Isomeric SMILES

COC1=CC=C(C=C1)CN2C(=O)CC(=C2[O-])S(=O)(=O)C3=CC=CC=C3.[Na+]

InChI

InChI=1S/C18H17NO5S.Na/c1-24-14-9-7-13(8-10-14)12-19-17(20)11-16(18(19)21)25(22,23)15-5-3-2-4-6-15;/h2-10,21H,11-12H2,1H3;/q;+1/p-1