N-(4-chloranyl-3-pyrrolidin-1-ylsulfonyl-phenyl)-3-(2-ethoxyphenyl)propanamide

Systemtic Name: N-(4-chloranyl-3-pyrrolidin-1-ylsulfonyl-phenyl)-3-(2-ethoxyphenyl)propanamide Openeye Name: N-(4-chloro-3-pyrrolidin-1-ylsulfonyl-phenyl)-3-(2-ethoxyphenyl)propanamide CAS Name: N-[4-chloro-3-(1-pyrrolidinylsulfonyl)phenyl]-3-(2-ethoxyphenyl)propanamide IUPAC Name: N-(4-chloro-3-pyrrolidin-1-ylsulfonylphenyl)-3-(2-ethoxyphenyl)propanamide Traditional Name: N-(4-chloro-3-pyrrolidinosulfonyl-phenyl)-3-o-phenetyl-propionamide Formula: C21H25ClN2O4S MolecularWeight: 436.9522

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1CCC(=O)NC2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCC3

Isomeric SMILES

CCOC1=CC=CC=C1CCC(=O)NC2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C21H25ClN2O4S/c1-2-28-19-8-4-3-7-16(19)9-12-21(25)23-17-10-11-18(22)20(15-17)29(26,27)24-13-5-6-14-24/h3-4,7-8,10-11,15H,2,5-6,9,12-14H2,1H3,(H,23,25)