N-[(E)-(4-methylphenyl)methylideneamino]-4-morpholin-4-ylsulfonyl-2-nitro-aniline

Systemtic Name: N-[(E)-(4-methylphenyl)methylideneamino]-4-morpholin-4-ylsulfonyl-2-nitro-aniline Openeye Name: 4-morpholinosulfonyl-2-nitro-N-[(E)-p-tolylmethyleneamino]aniline CAS Name: N-[(E)-(4-methylphenyl)methylideneamino]-4-(4-morpholinylsulfonyl)-2-nitroaniline IUPAC Name: N-[(E)-(4-methylphenyl)methylideneamino]-4-morpholin-4-ylsulfonyl-2-nitroaniline Traditional Name: [(E)-(4-methylbenzylidene)amino]-(4-morpholinosulfonyl-2-nitro-phenyl)amine Formula: C18H20N4O5S MolecularWeight: 404.4402

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C=NNC2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)/C=N/NC2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)[N+](=O)[O-]

InChI

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