(E)-N-(4-chloranyl-3-pyrrolidin-1-ylsulfonyl-phenyl)-3-(2-methoxyphenyl)prop-2-enamide

Systemtic Name: (E)-N-(4-chloranyl-3-pyrrolidin-1-ylsulfonyl-phenyl)-3-(2-methoxyphenyl)prop-2-enamide Openeye Name: (E)-N-(4-chloro-3-pyrrolidin-1-ylsulfonyl-phenyl)-3-(2-methoxyphenyl)prop-2-enamide CAS Name: (E)-N-[4-chloro-3-(1-pyrrolidinylsulfonyl)phenyl]-3-(2-methoxyphenyl)-2-propenamide IUPAC Name: (E)-N-(4-chloro-3-pyrrolidin-1-ylsulfonylphenyl)-3-(2-methoxyphenyl)prop-2-enamide Traditional Name: (E)-N-(4-chloro-3-pyrrolidinosulfonyl-phenyl)-3-(2-methoxyphenyl)acrylamide Formula: C20H21ClN2O4S MolecularWeight: 420.90974

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C=CC(=O)NC2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCC3

Isomeric SMILES

COC1=CC=CC=C1/C=C/C(=O)NC2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C20H21ClN2O4S/c1-27-18-7-3-2-6-15(18)8-11-20(24)22-16-9-10-17(21)19(14-16)28(25,26)23-12-4-5-13-23/h2-3,6-11,14H,4-5,12-13H2,1H3,(H,22,24)/b11-8+