N-[(E)-1-(1,3-benzodioxol-5-yl)ethylideneamino]-4-morpholin-4-ylsulfonyl-2-nitro-aniline

Systemtic Name: N-[(E)-1-(1,3-benzodioxol-5-yl)ethylideneamino]-4-morpholin-4-ylsulfonyl-2-nitro-aniline Openeye Name: N-[(E)-1-(1,3-benzodioxol-5-yl)ethylideneamino]-4-morpholinosulfonyl-2-nitro-aniline CAS Name: N-[(E)-1-(1,3-benzodioxol-5-yl)ethylideneamino]-4-(4-morpholinylsulfonyl)-2-nitroaniline IUPAC Name: N-[(E)-1-(1,3-benzodioxol-5-yl)ethylideneamino]-4-morpholin-4-ylsulfonyl-2-nitroaniline Traditional Name: [(E)-1-(1,3-benzodioxol-5-yl)ethylideneamino]-(4-morpholinosulfonyl-2-nitro-phenyl)amine Formula: C19H20N4O7S MolecularWeight: 448.4497

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)[N+](=O)[O-])C3=CC4=C(C=C3)OCO4

Isomeric SMILES

C/C(=N\NC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)[N+](=O)[O-])/C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C19H20N4O7S/c1-13(14-2-5-18-19(10-14)30-12-29-18)20-21-16-4-3-15(11-17(16)23(24)25)31(26,27)22-6-8-28-9-7-22/h2-5,10-11,21H,6-9,12H2,1H3/b20-13+