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

Systemtic Name: N-[[5-(4-chlorophenyl)furan-2-yl]methyl]-4-morpholin-4-ylsulfonyl-2-nitro-aniline Openeye Name: N-[[5-(4-chlorophenyl)-2-furyl]methyl]-4-morpholinosulfonyl-2-nitro-aniline CAS Name: N-[[5-(4-chlorophenyl)-2-furanyl]methyl]-4-(4-morpholinylsulfonyl)-2-nitroaniline IUPAC Name: N-[[5-(4-chlorophenyl)furan-2-yl]methyl]-4-morpholin-4-ylsulfonyl-2-nitroaniline Traditional Name: [5-(4-chlorophenyl)-2-furyl]methyl-(4-morpholinosulfonyl-2-nitro-phenyl)amine Formula: C21H20ClN3O6S MolecularWeight: 477.918

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC(=C(C=C2)NCC3=CC=C(O3)C4=CC=C(C=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC(=C(C=C2)NCC3=CC=C(O3)C4=CC=C(C=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C21H20ClN3O6S/c22-16-3-1-15(2-4-16)21-8-5-17(31-21)14-23-19-7-6-18(13-20(19)25(26)27)32(28,29)24-9-11-30-12-10-24/h1-8,13,23H,9-12,14H2