[4-(4-methoxyphenyl)piperazin-1-yl]-[3-nitro-4-(oxolan-2-ylmethylsulfonyl)phenyl]methanone

Systemtic Name: [4-(4-methoxyphenyl)piperazin-1-yl]-[3-nitro-4-(oxolan-2-ylmethylsulfonyl)phenyl]methanone Openeye Name: [4-(4-methoxyphenyl)piperazin-1-yl]-[3-nitro-4-(tetrahydrofuran-2-ylmethylsulfonyl)phenyl]methanone CAS Name: [4-(4-methoxyphenyl)-1-piperazinyl]-[3-nitro-4-(2-oxolanylmethylsulfonyl)phenyl]methanone IUPAC Name: [4-(4-methoxyphenyl)piperazin-1-yl]-[3-nitro-4-(oxolan-2-ylmethylsulfonyl)phenyl]methanone Traditional Name: [4-(4-methoxyphenyl)piperazino]-[3-nitro-4-(tetrahydrofurfurylsulfonyl)phenyl]methanone Formula: C23H27N3O7S MolecularWeight: 489.54138

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CCN(CC2)C(=O)C3=CC(=C(C=C3)S(=O)(=O)CC4CCCO4)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)N2CCN(CC2)C(=O)C3=CC(=C(C=C3)S(=O)(=O)CC4CCCO4)[N+](=O)[O-]

InChI

InChI=1S/C23H27N3O7S/c1-32-19-7-5-18(6-8-19)24-10-12-25(13-11-24)23(27)17-4-9-22(21(15-17)26(28)29)34(30,31)16-20-3-2-14-33-20/h4-9,15,20H,2-3,10-14,16H2,1H3