3-[3,5-bis(bromanyl)-2-methoxy-phenyl]-N-(3-chloranyl-2-pyrrolidin-1-yl-phenyl)prop-2-enamide

Systemtic Name: 3-[3,5-bis(bromanyl)-2-methoxy-phenyl]-N-(3-chloranyl-2-pyrrolidin-1-yl-phenyl)prop-2-enamide Openeye Name: N-(3-chloro-2-pyrrolidin-1-yl-phenyl)-3-(3,5-dibromo-2-methoxy-phenyl)prop-2-enamide CAS Name: N-[3-chloro-2-(1-pyrrolidinyl)phenyl]-3-(3,5-dibromo-2-methoxyphenyl)-2-propenamide IUPAC Name: N-(3-chloro-2-pyrrolidin-1-ylphenyl)-3-(3,5-dibromo-2-methoxyphenyl)prop-2-enamide Traditional Name: N-(3-chloro-2-pyrrolidino-phenyl)-3-(3,5-dibromo-2-methoxy-phenyl)acrylamide Formula: C20H19Br2ClN2O2 MolecularWeight: 514.63806

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H19Br2ClN2O2/c1-27-20-13(11-14(21)12-15(20)22)7-8-18(26)24-17-6-4-5-16(23)19(17)25-9-2-3-10-25/h4-8,11-12H,2-3,9-10H2,1H3,(H,24,26)