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

Systemtic Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-2-morpholin-4-ylsulfonyl-4-nitro-aniline Openeye Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-2-morpholinosulfonyl-4-nitro-aniline CAS Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-2-(4-morpholinylsulfonyl)-4-nitroaniline IUPAC Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-2-morpholin-4-ylsulfonyl-4-nitroaniline Traditional Name: homopiperonyl-(2-morpholinosulfonyl-4-nitro-phenyl)amine Formula: C19H21N3O7S MolecularWeight: 435.45094

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=C(C=CC(=C2)[N+](=O)[O-])NCCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=C(C=CC(=C2)[N+](=O)[O-])NCCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C19H21N3O7S/c23-22(24)15-2-3-16(19(12-15)30(25,26)21-7-9-27-10-8-21)20-6-5-14-1-4-17-18(11-14)29-13-28-17/h1-4,11-12,20H,5-10,13H2