2-[(2-methyl-5-morpholin-4-ylsulfonyl-phenyl)iminomethyl]-4-nitro-phenolate

Systemtic Name: 2-[(2-methyl-5-morpholin-4-ylsulfonyl-phenyl)iminomethyl]-4-nitro-phenolate Openeye Name: 2-[(2-methyl-5-morpholinosulfonyl-phenyl)iminomethyl]-4-nitro-phenolate CAS Name: 2-[[2-methyl-5-(4-morpholinylsulfonyl)phenyl]iminomethyl]-4-nitrophenolate IUPAC Name: 2-[(2-methyl-5-morpholin-4-ylsulfonylphenyl)iminomethyl]-4-nitrophenolate Traditional Name: 2-[(2-methyl-5-morpholinosulfonyl-phenyl)iminomethyl]-4-nitro-phenolate Formula: C18H18N3O6S- MolecularWeight: 404.41702

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)N=CC3=C(C=CC(=C3)[N+](=O)[O-])[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)N=CC3=C(C=CC(=C3)[N+](=O)[O-])[O-]

InChI

InChI=1S/C18H19N3O6S/c1-13-2-4-16(28(25,26)20-6-8-27-9-7-20)11-17(13)19-12-14-10-15(21(23)24)3-5-18(14)22/h2-5,10-12,22H,6-9H2,1H3/p-1