N-[2-(1,3-benzodioxol-5-yl)ethyl]-4-[(4-methyl-3-nitro-phenyl)sulfonylamino]benzamide

Systemtic Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-4-[(4-methyl-3-nitro-phenyl)sulfonylamino]benzamide Openeye Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-4-[(4-methyl-3-nitro-phenyl)sulfonylamino]benzamide CAS Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-4-[(4-methyl-3-nitrophenyl)sulfonylamino]benzamide IUPAC Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-4-[(4-methyl-3-nitrophenyl)sulfonylamino]benzamide Traditional Name: N-homopiperonyl-4-[(4-methyl-3-nitro-phenyl)sulfonylamino]benzamide Formula: C23H21N3O7S MolecularWeight: 483.49374

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C(=O)NCCC3=CC4=C(C=C3)OCO4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C(=O)NCCC3=CC4=C(C=C3)OCO4)[N+](=O)[O-]

InChI

InChI=1S/C23H21N3O7S/c1-15-2-8-19(13-20(15)26(28)29)34(30,31)25-18-6-4-17(5-7-18)23(27)24-11-10-16-3-9-21-22(12-16)33-14-32-21/h2-9,12-13,25H,10-11,14H2,1H3,(H,24,27)