[6-[2,5-bis(methoxycarbonyl)phenyl]sulfonyliminocyclohexa-2,4-dien-1-ylidene]-morpholin-4-yl-methanolate

Systemtic Name: [6-[2,5-bis(methoxycarbonyl)phenyl]sulfonyliminocyclohexa-2,4-dien-1-ylidene]-morpholin-4-yl-methanolate Openeye Name: [6-[2,5-bis(methoxycarbonyl)phenyl]sulfonyliminocyclohexa-2,4-dien-1-ylidene]-morpholino-methanolate CAS Name: [6-[2,5-bis(methoxycarbonyl)phenyl]sulfonylimino-1-cyclohexa-2,4-dienylidene]-(4-morpholinyl)methanolate IUPAC Name: [6-[2,5-bis(methoxycarbonyl)phenyl]sulfonyliminocyclohexa-2,4-dien-1-ylidene]-morpholin-4-ylmethanolate Traditional Name: [6-(2,5-dicarbomethoxyphenyl)sulfonyliminocyclohexa-2,4-dien-1-ylidene]-morpholino-methanolate Formula: C21H21N2O8S- MolecularWeight: 461.46504

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)C(=O)OC)S(=O)(=O)N=C2C=CC=CC2=C(N3CCOCC3)[O-]

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)C(=O)OC)S(=O)(=O)N=C2C=CC=CC2=C(N3CCOCC3)[O-]

InChI

InChI=1S/C21H22N2O8S/c1-29-20(25)14-7-8-16(21(26)30-2)18(13-14)32(27,28)22-17-6-4-3-5-15(17)19(24)23-9-11-31-12-10-23/h3-8,13,24H,9-12H2,1-2H3/p-1