[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]-(2,4,5-trimethylfuran-3-yl)methanone

Systemtic Name: [4-(2-nitrophenyl)sulfonylpiperazin-1-yl]-(2,4,5-trimethylfuran-3-yl)methanone Openeye Name: [4-(2-nitrophenyl)sulfonylpiperazin-1-yl]-(2,4,5-trimethyl-3-furyl)methanone CAS Name: [4-(2-nitrophenyl)sulfonyl-1-piperazinyl]-(2,4,5-trimethyl-3-furanyl)methanone IUPAC Name: [4-(2-nitrophenyl)sulfonylpiperazin-1-yl]-(2,4,5-trimethylfuran-3-yl)methanone Traditional Name: [4-(2-nitrophenyl)sulfonylpiperazino]-(2,4,5-trimethyl-3-furyl)methanone Formula: C18H21N3O6S MolecularWeight: 407.44084

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC(=C1C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3[N+](=O)[O-])C)C

Isomeric SMILES

CC1=C(OC(=C1C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3[N+](=O)[O-])C)C

InChI

InChI=1S/C18H21N3O6S/c1-12-13(2)27-14(3)17(12)18(22)19-8-10-20(11-9-19)28(25,26)16-7-5-4-6-15(16)21(23)24/h4-7H,8-11H2,1-3H3