N-(1,3-benzodioxol-5-ylmethyl)-4-methylsulfonyl-2-nitro-aniline

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-4-methylsulfonyl-2-nitro-aniline Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-4-methylsulfonyl-2-nitro-aniline CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-4-methylsulfonyl-2-nitroaniline IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-4-methylsulfonyl-2-nitroaniline Traditional Name: (4-mesyl-2-nitro-phenyl)-piperonyl-amine Formula: C15H14N2O6S MolecularWeight: 350.34646

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)NCC2=CC3=C(C=C2)OCO3)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)NCC2=CC3=C(C=C2)OCO3)[N+](=O)[O-]

InChI

InChI=1S/C15H14N2O6S/c1-24(20,21)11-3-4-12(13(7-11)17(18)19)16-8-10-2-5-14-15(6-10)23-9-22-14/h2-7,16H,8-9H2,1H3