N-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)-3-methoxy-4-methyl-benzamide

Systemtic Name: N-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)-3-methoxy-4-methyl-benzamide Openeye Name: N-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)-3-methoxy-4-methyl-benzamide CAS Name: N-[4-ethoxy-3-(1-pyrrolidinylsulfonyl)phenyl]-3-methoxy-4-methylbenzamide IUPAC Name: N-(4-ethoxy-3-pyrrolidin-1-ylsulfonylphenyl)-3-methoxy-4-methylbenzamide Traditional Name: N-(4-ethoxy-3-pyrrolidinosulfonyl-phenyl)-3-methoxy-4-methyl-benzamide Formula: C21H26N2O5S MolecularWeight: 418.50654

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26N2O5S/c1-4-28-18-10-9-17(14-20(18)29(25,26)23-11-5-6-12-23)22-21(24)16-8-7-15(2)19(13-16)27-3/h7-10,13-14H,4-6,11-12H2,1-3H3,(H,22,24)