N-[(E)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethylideneamino]-4-morpholin-4-ylsulfonyl-2-nitro-aniline

Systemtic Name: N-[(E)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethylideneamino]-4-morpholin-4-ylsulfonyl-2-nitro-aniline Openeye Name: N-[(E)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethylideneamino]-4-morpholinosulfonyl-2-nitro-aniline CAS Name: N-[(E)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethylideneamino]-4-(4-morpholinylsulfonyl)-2-nitroaniline IUPAC Name: N-[(E)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethylideneamino]-4-morpholin-4-ylsulfonyl-2-nitroaniline Traditional Name: [(E)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethylideneamino]-(4-morpholinosulfonyl-2-nitro-phenyl)amine Formula: C20H22N4O7S MolecularWeight: 462.47628

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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)OCCO4

Isomeric SMILES

C/C(=N\NC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)[N+](=O)[O-])/C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C20H22N4O7S/c1-14(15-2-5-19-20(12-15)31-11-10-30-19)21-22-17-4-3-16(13-18(17)24(25)26)32(27,28)23-6-8-29-9-7-23/h2-5,12-13,22H,6-11H2,1H3/b21-14+