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

Systemtic Name: N-[(E)-2,3-dihydro-1,4-benzodioxin-6-ylmethylideneamino]-4-morpholin-4-ylsulfonyl-2-nitro-aniline Openeye Name: N-[(E)-2,3-dihydro-1,4-benzodioxin-6-ylmethyleneamino]-4-morpholinosulfonyl-2-nitro-aniline CAS Name: N-[(E)-2,3-dihydro-1,4-benzodioxin-6-ylmethylideneamino]-4-(4-morpholinylsulfonyl)-2-nitroaniline IUPAC Name: N-[(E)-2,3-dihydro-1,4-benzodioxin-6-ylmethylideneamino]-4-morpholin-4-ylsulfonyl-2-nitroaniline Traditional Name: [(E)-2,3-dihydro-1,4-benzodioxin-6-ylmethyleneamino]-(4-morpholinosulfonyl-2-nitro-phenyl)amine Formula: C19H20N4O7S MolecularWeight: 448.4497

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC(=C(C=C2)NN=CC3=CC4=C(C=C3)OCCO4)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC(=C(C=C2)N/N=C/C3=CC4=C(C=C3)OCCO4)[N+](=O)[O-]

InChI

InChI=1S/C19H20N4O7S/c24-23(25)17-12-15(31(26,27)22-5-7-28-8-6-22)2-3-16(17)21-20-13-14-1-4-18-19(11-14)30-10-9-29-18/h1-4,11-13,21H,5-10H2/b20-13+