2-chloranyl-N-[4-chloranyl-3-(1-methylpyrrolidin-3-yl)oxy-phenyl]-4-isocyano-benzenesulfonamide

Systemtic Name: 2-chloranyl-N-[4-chloranyl-3-(1-methylpyrrolidin-3-yl)oxy-phenyl]-4-isocyano-benzenesulfonamide Openeye Name: 2-chloro-N-[4-chloro-3-(1-methylpyrrolidin-3-yl)oxy-phenyl]-4-isocyano-benzenesulfonamide CAS Name: 2-chloro-N-[4-chloro-3-[(1-methyl-3-pyrrolidinyl)oxy]phenyl]-4-isocyanobenzenesulfonamide IUPAC Name: 2-chloro-N-[4-chloro-3-(1-methylpyrrolidin-3-yl)oxyphenyl]-4-isocyanobenzenesulfonamide Traditional Name: 2-chloro-N-[4-chloro-3-(1-methylpyrrolidin-3-yl)oxy-phenyl]-4-isocyano-benzenesulfonamide Formula: C18H17Cl2N3O3S MolecularWeight: 426.31688

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(C1)OC2=C(C=CC(=C2)NS(=O)(=O)C3=C(C=C(C=C3)[N+]#[C-])Cl)Cl

Isomeric SMILES

CN1CCC(C1)OC2=C(C=CC(=C2)NS(=O)(=O)C3=C(C=C(C=C3)[N+]#[C-])Cl)Cl

InChI

InChI=1S/C18H17Cl2N3O3S/c1-21-12-4-6-18(16(20)9-12)27(24,25)22-13-3-5-15(19)17(10-13)26-14-7-8-23(2)11-14/h3-6,9-10,14,22H,7-8,11H2,2H3