N-[(E)-(4-butoxy-3-methoxy-phenyl)methylideneamino]-4-morpholin-4-ylsulfonyl-2-nitro-aniline

Systemtic Name: N-[(E)-(4-butoxy-3-methoxy-phenyl)methylideneamino]-4-morpholin-4-ylsulfonyl-2-nitro-aniline Openeye Name: N-[(E)-(4-butoxy-3-methoxy-phenyl)methyleneamino]-4-morpholinosulfonyl-2-nitro-aniline CAS Name: N-[(E)-(4-butoxy-3-methoxyphenyl)methylideneamino]-4-(4-morpholinylsulfonyl)-2-nitroaniline IUPAC Name: N-[(E)-(4-butoxy-3-methoxyphenyl)methylideneamino]-4-morpholin-4-ylsulfonyl-2-nitroaniline Traditional Name: [(E)-(4-butoxy-3-methoxy-benzylidene)amino]-(4-morpholinosulfonyl-2-nitro-phenyl)amine Formula: C22H28N4O7S MolecularWeight: 492.54532

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C=NNC2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)[N+](=O)[O-])OC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)/C=N/NC2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)[N+](=O)[O-])OC

InChI

InChI=1S/C22H28N4O7S/c1-3-4-11-33-21-8-5-17(14-22(21)31-2)16-23-24-19-7-6-18(15-20(19)26(27)28)34(29,30)25-9-12-32-13-10-25/h5-8,14-16,24H,3-4,9-13H2,1-2H3/b23-16+