N-[[4-(3-methylbutoxy)phenyl]methylideneamino]-4-morpholin-4-ylsulfonyl-2-nitro-aniline

Systemtic Name: N-[[4-(3-methylbutoxy)phenyl]methylideneamino]-4-morpholin-4-ylsulfonyl-2-nitro-aniline Openeye Name: N-[(4-isopentyloxyphenyl)methyleneamino]-4-morpholinosulfonyl-2-nitro-aniline CAS Name: N-[[4-(3-methylbutoxy)phenyl]methylideneamino]-4-(4-morpholinylsulfonyl)-2-nitroaniline IUPAC Name: N-[[4-(3-methylbutoxy)phenyl]methylideneamino]-4-morpholin-4-ylsulfonyl-2-nitroaniline Traditional Name: [(4-isoamoxybenzylidene)amino]-(4-morpholinosulfonyl-2-nitro-phenyl)amine Formula: C22H28N4O6S MolecularWeight: 476.54592

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=CC=C(C=C1)C=NNC2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)[N+](=O)[O-]

Isomeric SMILES

CC(C)CCOC1=CC=C(C=C1)C=NNC2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)[N+](=O)[O-]

InChI

InChI=1S/C22H28N4O6S/c1-17(2)9-12-32-19-5-3-18(4-6-19)16-23-24-21-8-7-20(15-22(21)26(27)28)33(29,30)25-10-13-31-14-11-25/h3-8,15-17,24H,9-14H2,1-2H3