N-[[5-(4-chlorophenyl)furan-2-yl]methyl]-4-methylsulfonyl-2-nitro-aniline

Systemtic Name: N-[[5-(4-chlorophenyl)furan-2-yl]methyl]-4-methylsulfonyl-2-nitro-aniline Openeye Name: N-[[5-(4-chlorophenyl)-2-furyl]methyl]-4-methylsulfonyl-2-nitro-aniline CAS Name: N-[[5-(4-chlorophenyl)-2-furanyl]methyl]-4-methylsulfonyl-2-nitroaniline IUPAC Name: N-[[5-(4-chlorophenyl)furan-2-yl]methyl]-4-methylsulfonyl-2-nitroaniline Traditional Name: [5-(4-chlorophenyl)-2-furyl]methyl-(4-mesyl-2-nitro-phenyl)amine Formula: C18H15ClN2O5S MolecularWeight: 406.8401

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)NCC2=CC=C(O2)C3=CC=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)NCC2=CC=C(O2)C3=CC=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C18H15ClN2O5S/c1-27(24,25)15-7-8-16(17(10-15)21(22)23)20-11-14-6-9-18(26-14)12-2-4-13(19)5-3-12/h2-10,20H,11H2,1H3