(2S)-2-(3-chloranylphenoxy)-N-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)propanamide

Systemtic Name: (2S)-2-(3-chloranylphenoxy)-N-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)propanamide Openeye Name: (2S)-2-(3-chlorophenoxy)-N-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)propanamide CAS Name: (2S)-2-(3-chlorophenoxy)-N-[4-ethoxy-3-(1-pyrrolidinylsulfonyl)phenyl]propanamide IUPAC Name: (2S)-2-(3-chlorophenoxy)-N-(4-ethoxy-3-pyrrolidin-1-ylsulfonylphenyl)propanamide Traditional Name: (2S)-2-(3-chlorophenoxy)-N-(4-ethoxy-3-pyrrolidinosulfonyl-phenyl)propionamide Formula: C21H25ClN2O5S MolecularWeight: 452.9516

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC(=O)C(C)OC2=CC(=CC=C2)Cl)S(=O)(=O)N3CCCC3

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC(=O)[C@H](C)OC2=CC(=CC=C2)Cl)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C21H25ClN2O5S/c1-3-28-19-10-9-17(14-20(19)30(26,27)24-11-4-5-12-24)23-21(25)15(2)29-18-8-6-7-16(22)13-18/h6-10,13-15H,3-5,11-12H2,1-2H3,(H,23,25)/t15-/m0/s1