3-chloranyl-N-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)-4,5-dimethoxy-benzamide

Systemtic Name: 3-chloranyl-N-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)-4,5-dimethoxy-benzamide Openeye Name: 3-chloro-N-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)-4,5-dimethoxy-benzamide CAS Name: 3-chloro-N-[4-ethoxy-3-(1-pyrrolidinylsulfonyl)phenyl]-4,5-dimethoxybenzamide IUPAC Name: 3-chloro-N-(4-ethoxy-3-pyrrolidin-1-ylsulfonylphenyl)-4,5-dimethoxybenzamide Traditional Name: 3-chloro-N-(4-ethoxy-3-pyrrolidinosulfonyl-phenyl)-4,5-dimethoxy-benzamide Formula: C21H25ClN2O6S MolecularWeight: 468.951

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC(=O)C2=CC(=C(C(=C2)Cl)OC)OC)S(=O)(=O)N3CCCC3

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC(=O)C2=CC(=C(C(=C2)Cl)OC)OC)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C21H25ClN2O6S/c1-4-30-17-8-7-15(13-19(17)31(26,27)24-9-5-6-10-24)23-21(25)14-11-16(22)20(29-3)18(12-14)28-2/h7-8,11-13H,4-6,9-10H2,1-3H3,(H,23,25)