[3-(2-chloranyl-4-methyl-phenyl)sulfonylimino-1-benzofuran-2-ylidene]-morpholin-4-yl-methanolate

Systemtic Name: [3-(2-chloranyl-4-methyl-phenyl)sulfonylimino-1-benzofuran-2-ylidene]-morpholin-4-yl-methanolate Openeye Name: [3-(2-chloro-4-methyl-phenyl)sulfonyliminobenzofuran-2-ylidene]-morpholino-methanolate CAS Name: [3-(2-chloro-4-methylphenyl)sulfonylimino-2-benzofuranylidene]-(4-morpholinyl)methanolate IUPAC Name: [3-(2-chloro-4-methylphenyl)sulfonylimino-1-benzofuran-2-ylidene]-morpholin-4-ylmethanolate Traditional Name: [3-(2-chloro-4-methyl-phenyl)sulfonyliminocoumaran-2-ylidene]-morpholino-methanolate Formula: C20H18ClN2O5S- MolecularWeight: 433.88532

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)(=O)N=C2C3=CC=CC=C3OC2=C(N4CCOCC4)[O-])Cl

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)N=C2C3=CC=CC=C3OC2=C(N4CCOCC4)[O-])Cl

InChI

InChI=1S/C20H19ClN2O5S/c1-13-6-7-17(15(21)12-13)29(25,26)22-18-14-4-2-3-5-16(14)28-19(18)20(24)23-8-10-27-11-9-23/h2-7,12,24H,8-11H2,1H3/p-1