N-(1,3-benzodioxol-5-ylmethylideneamino)-4-morpholin-4-ylsulfonyl-2-nitro-aniline

Systemtic Name: N-(1,3-benzodioxol-5-ylmethylideneamino)-4-morpholin-4-ylsulfonyl-2-nitro-aniline Openeye Name: N-(1,3-benzodioxol-5-ylmethyleneamino)-4-morpholinosulfonyl-2-nitro-aniline CAS Name: N-(1,3-benzodioxol-5-ylmethylideneamino)-4-(4-morpholinylsulfonyl)-2-nitroaniline IUPAC Name: N-(1,3-benzodioxol-5-ylmethylideneamino)-4-morpholin-4-ylsulfonyl-2-nitroaniline Traditional Name: (4-morpholinosulfonyl-2-nitro-phenyl)-(piperonylideneamino)amine Formula: C18H18N4O7S MolecularWeight: 434.42312

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC(=C(C=C2)NN=CC3=CC4=C(C=C3)OCO4)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC(=C(C=C2)NN=CC3=CC4=C(C=C3)OCO4)[N+](=O)[O-]

InChI

InChI=1S/C18H18N4O7S/c23-22(24)16-10-14(30(25,26)21-5-7-27-8-6-21)2-3-15(16)20-19-11-13-1-4-17-18(9-13)29-12-28-17/h1-4,9-11,20H,5-8,12H2