4-methyl-N-[(E)-(4-morpholin-4-ylphenyl)methylideneamino]-3-nitro-benzenesulfonamide

Systemtic Name: 4-methyl-N-[(E)-(4-morpholin-4-ylphenyl)methylideneamino]-3-nitro-benzenesulfonamide Openeye Name: 4-methyl-N-[(E)-(4-morpholinophenyl)methyleneamino]-3-nitro-benzenesulfonamide CAS Name: 4-methyl-N-[(E)-[4-(4-morpholinyl)phenyl]methylideneamino]-3-nitrobenzenesulfonamide IUPAC Name: 4-methyl-N-[(E)-(4-morpholin-4-ylphenyl)methylideneamino]-3-nitrobenzenesulfonamide Traditional Name: 4-methyl-N-[(E)-(4-morpholinobenzylidene)amino]-3-nitro-benzenesulfonamide Formula: C18H20N4O5S MolecularWeight: 404.4402

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NN=CC2=CC=C(C=C2)N3CCOCC3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N/N=C/C2=CC=C(C=C2)N3CCOCC3)[N+](=O)[O-]

InChI

InChI=1S/C18H20N4O5S/c1-14-2-7-17(12-18(14)22(23)24)28(25,26)20-19-13-15-3-5-16(6-4-15)21-8-10-27-11-9-21/h2-7,12-13,20H,8-11H2,1H3/b19-13+