(E)-3-(3-chloranyl-5-ethoxy-4-prop-2-ynoxy-phenyl)-2-cyano-N-[2-(1H-indol-3-yl)ethyl]prop-2-enamide

Systemtic Name: (E)-3-(3-chloranyl-5-ethoxy-4-prop-2-ynoxy-phenyl)-2-cyano-N-[2-(1H-indol-3-yl)ethyl]prop-2-enamide Openeye Name: (E)-3-(3-chloro-5-ethoxy-4-prop-2-ynoxy-phenyl)-2-cyano-N-[2-(1H-indol-3-yl)ethyl]prop-2-enamide CAS Name: (E)-3-(3-chloro-5-ethoxy-4-prop-2-ynoxyphenyl)-2-cyano-N-[2-(1H-indol-3-yl)ethyl]-2-propenamide IUPAC Name: (E)-3-(3-chloro-5-ethoxy-4-prop-2-ynoxyphenyl)-2-cyano-N-[2-(1H-indol-3-yl)ethyl]prop-2-enamide Traditional Name: (E)-3-(3-chloro-5-ethoxy-4-propargyloxy-phenyl)-2-cyano-N-[2-(1H-indol-3-yl)ethyl]acrylamide Formula: C25H22ClN3O3 MolecularWeight: 447.91348

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=C(C#N)C(=O)NCCC2=CNC3=CC=CC=C32)Cl)OCC#C

Isomeric SMILES

CCOC1=C(C(=CC(=C1)/C=C(\C#N)/C(=O)NCCC2=CNC3=CC=CC=C32)Cl)OCC#C

InChI

InChI=1S/C25H22ClN3O3/c1-3-11-32-24-21(26)13-17(14-23(24)31-4-2)12-19(15-27)25(30)28-10-9-18-16-29-22-8-6-5-7-20(18)22/h1,5-8,12-14,16,29H,4,9-11H2,2H3,(H,28,30)/b19-12+