(E)-3-(6-bromanyl-1,3-benzodioxol-5-yl)-N-(3-chloranyl-2-methyl-phenyl)-2-cyano-prop-2-enamide

Systemtic Name: (E)-3-(6-bromanyl-1,3-benzodioxol-5-yl)-N-(3-chloranyl-2-methyl-phenyl)-2-cyano-prop-2-enamide Openeye Name: (E)-3-(6-bromo-1,3-benzodioxol-5-yl)-N-(3-chloro-2-methyl-phenyl)-2-cyano-prop-2-enamide CAS Name: (E)-3-(6-bromo-1,3-benzodioxol-5-yl)-N-(3-chloro-2-methylphenyl)-2-cyano-2-propenamide IUPAC Name: (E)-3-(6-bromo-1,3-benzodioxol-5-yl)-N-(3-chloro-2-methylphenyl)-2-cyanoprop-2-enamide Traditional Name: (E)-3-(6-bromo-1,3-benzodioxol-5-yl)-N-(3-chloro-2-methyl-phenyl)-2-cyano-acrylamide Formula: C18H12BrClN2O3 MolecularWeight: 419.65648

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=O)C(=CC2=CC3=C(C=C2Br)OCO3)C#N

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=O)/C(=C/C2=CC3=C(C=C2Br)OCO3)/C#N

InChI

InChI=1S/C18H12BrClN2O3/c1-10-14(20)3-2-4-15(10)22-18(23)12(8-21)5-11-6-16-17(7-13(11)19)25-9-24-16/h2-7H,9H2,1H3,(H,22,23)/b12-5+