N-(3-chloranyl-2,6-diethyl-phenyl)-4-methoxy-3-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-(3-chloranyl-2,6-diethyl-phenyl)-4-methoxy-3-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-(3-chloro-2,6-diethyl-phenyl)-4-methoxy-3-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-(3-chloro-2,6-diethylphenyl)-4-methoxy-3-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-(3-chloro-2,6-diethylphenyl)-4-methoxy-3-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-(3-chloro-2,6-diethyl-phenyl)-4-methoxy-3-pyrrolidinosulfonyl-benzamide Formula: C22H27ClN2O4S MolecularWeight: 450.97878

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(C=C1)Cl)CC)NC(=O)C2=CC(=C(C=C2)OC)S(=O)(=O)N3CCCC3

Isomeric SMILES

CCC1=C(C(=C(C=C1)Cl)CC)NC(=O)C2=CC(=C(C=C2)OC)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C22H27ClN2O4S/c1-4-15-8-10-18(23)17(5-2)21(15)24-22(26)16-9-11-19(29-3)20(14-16)30(27,28)25-12-6-7-13-25/h8-11,14H,4-7,12-13H2,1-3H3,(H,24,26)