(E)-3-[1-(4-bromanylnaphthalen-1-yl)-2,5-dimethyl-pyrrol-3-yl]-2-cyano-N-cyclopropyl-prop-2-enamide

Systemtic Name: (E)-3-[1-(4-bromanylnaphthalen-1-yl)-2,5-dimethyl-pyrrol-3-yl]-2-cyano-N-cyclopropyl-prop-2-enamide Openeye Name: (E)-3-[1-(4-bromo-1-naphthyl)-2,5-dimethyl-pyrrol-3-yl]-2-cyano-N-cyclopropyl-prop-2-enamide CAS Name: (E)-3-[1-(4-bromo-1-naphthalenyl)-2,5-dimethyl-3-pyrrolyl]-2-cyano-N-cyclopropyl-2-propenamide IUPAC Name: (E)-3-[1-(4-bromonaphthalen-1-yl)-2,5-dimethylpyrrol-3-yl]-2-cyano-N-cyclopropylprop-2-enamide Traditional Name: (E)-3-[1-(4-bromo-1-naphthyl)-2,5-dimethyl-pyrrol-3-yl]-2-cyano-N-cyclopropyl-acrylamide Formula: C23H20BrN3O MolecularWeight: 434.3284

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=C(C3=CC=CC=C32)Br)C)C=C(C#N)C(=O)NC4CC4

Isomeric SMILES

CC1=CC(=C(N1C2=CC=C(C3=CC=CC=C32)Br)C)/C=C(\C#N)/C(=O)NC4CC4

InChI

InChI=1S/C23H20BrN3O/c1-14-11-16(12-17(13-25)23(28)26-18-7-8-18)15(2)27(14)22-10-9-21(24)19-5-3-4-6-20(19)22/h3-6,9-12,18H,7-8H2,1-2H3,(H,26,28)/b17-12+