(E)-3-(5-bromanyl-2-prop-2-ynoxy-phenyl)-N-butyl-2-cyano-prop-2-enamide

Systemtic Name: (E)-3-(5-bromanyl-2-prop-2-ynoxy-phenyl)-N-butyl-2-cyano-prop-2-enamide Openeye Name: (E)-3-(5-bromo-2-prop-2-ynoxy-phenyl)-N-butyl-2-cyano-prop-2-enamide CAS Name: (E)-3-(5-bromo-2-prop-2-ynoxyphenyl)-N-butyl-2-cyano-2-propenamide IUPAC Name: (E)-3-(5-bromo-2-prop-2-ynoxyphenyl)-N-butyl-2-cyanoprop-2-enamide Traditional Name: (E)-3-(5-bromo-2-propargyloxy-phenyl)-N-butyl-2-cyano-acrylamide Formula: C17H17BrN2O2 MolecularWeight: 361.23308

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C(=CC1=C(C=CC(=C1)Br)OCC#C)C#N

Isomeric SMILES

CCCCNC(=O)/C(=C/C1=C(C=CC(=C1)Br)OCC#C)/C#N

InChI

InChI=1S/C17H17BrN2O2/c1-3-5-8-20-17(21)14(12-19)10-13-11-15(18)6-7-16(13)22-9-4-2/h2,6-7,10-11H,3,5,8-9H2,1H3,(H,20,21)/b14-10+