2-chloranyl-N-(2-methyl-3-nitro-phenyl)-5-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: 2-chloranyl-N-(2-methyl-3-nitro-phenyl)-5-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: 2-chloro-N-(2-methyl-3-nitro-phenyl)-5-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: 2-chloro-N-(2-methyl-3-nitrophenyl)-5-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: 2-chloro-N-(2-methyl-3-nitrophenyl)-5-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: 2-chloro-N-(2-methyl-3-nitro-phenyl)-5-pyrrolidinosulfonyl-benzamide Formula: C18H18ClN3O5S MolecularWeight: 423.87062

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCC3)Cl

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCC3)Cl

InChI

InChI=1S/C18H18ClN3O5S/c1-12-16(5-4-6-17(12)22(24)25)20-18(23)14-11-13(7-8-15(14)19)28(26,27)21-9-2-3-10-21/h4-8,11H,2-3,9-10H2,1H3,(H,20,23)