(2-methyl-2,3-dihydro-1,4-benzodioxin-3-yl)-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: (2-methyl-2,3-dihydro-1,4-benzodioxin-3-yl)-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]methanone Openeye Name: (2-methyl-2,3-dihydro-1,4-benzodioxin-3-yl)-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]methanone CAS Name: (2-methyl-2,3-dihydro-1,4-benzodioxin-3-yl)-[4-(3-nitrophenyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: (2-methyl-2,3-dihydro-1,4-benzodioxin-3-yl)-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]methanone Traditional Name: (2-methyl-2,3-dihydro-1,4-benzodioxin-3-yl)-[4-(3-nitrophenyl)sulfonylpiperazino]methanone Formula: C20H21N3O7S MolecularWeight: 447.46164

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(OC2=CC=CC=C2O1)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC(=C4)[N+](=O)[O-]

Isomeric SMILES

CC1C(OC2=CC=CC=C2O1)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC(=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H21N3O7S/c1-14-19(30-18-8-3-2-7-17(18)29-14)20(24)21-9-11-22(12-10-21)31(27,28)16-6-4-5-15(13-16)23(25)26/h2-8,13-14,19H,9-12H2,1H3