[6-(3-chloranyl-4-methyl-5-nitro-phenyl)sulfonyliminocyclohexa-2,4-dien-1-ylidene]-morpholin-4-yl-methanolate

Systemtic Name: [6-(3-chloranyl-4-methyl-5-nitro-phenyl)sulfonyliminocyclohexa-2,4-dien-1-ylidene]-morpholin-4-yl-methanolate Openeye Name: [6-(3-chloro-4-methyl-5-nitro-phenyl)sulfonyliminocyclohexa-2,4-dien-1-ylidene]-morpholino-methanolate CAS Name: [6-(3-chloro-4-methyl-5-nitrophenyl)sulfonylimino-1-cyclohexa-2,4-dienylidene]-(4-morpholinyl)methanolate IUPAC Name: [6-(3-chloro-4-methyl-5-nitrophenyl)sulfonyliminocyclohexa-2,4-dien-1-ylidene]-morpholin-4-ylmethanolate Traditional Name: [6-(3-chloro-4-methyl-5-nitro-phenyl)sulfonyliminocyclohexa-2,4-dien-1-ylidene]-morpholino-methanolate Formula: C18H17ClN3O6S- MolecularWeight: 438.86208

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1[N+](=O)[O-])S(=O)(=O)N=C2C=CC=CC2=C(N3CCOCC3)[O-])Cl

Isomeric SMILES

CC1=C(C=C(C=C1[N+](=O)[O-])S(=O)(=O)N=C2C=CC=CC2=C(N3CCOCC3)[O-])Cl

InChI

InChI=1S/C18H18ClN3O6S/c1-12-15(19)10-13(11-17(12)22(24)25)29(26,27)20-16-5-3-2-4-14(16)18(23)21-6-8-28-9-7-21/h2-5,10-11,23H,6-9H2,1H3/p-1