phenyl (E)-3-[1-(2-cyanoethyl)indol-3-yl]prop-2-enoate

Systemtic Name: phenyl (E)-3-[1-(2-cyanoethyl)indol-3-yl]prop-2-enoate Openeye Name: phenyl (E)-3-[1-(2-cyanoethyl)indol-3-yl]prop-2-enoate CAS Name: (E)-3-[1-(2-cyanoethyl)-3-indolyl]-2-propenoic acid phenyl ester IUPAC Name: phenyl (E)-3-[1-(2-cyanoethyl)indol-3-yl]prop-2-enoate Traditional Name: (E)-3-[1-(2-cyanoethyl)indol-3-yl]acrylic acid phenyl ester Formula: C20H16N2O2 MolecularWeight: 316.35324

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC(=O)C=CC2=CN(C3=CC=CC=C32)CCC#N

Isomeric SMILES

C1=CC=C(C=C1)OC(=O)/C=C/C2=CN(C3=CC=CC=C32)CCC#N

InChI

InChI=1S/C20H16N2O2/c21-13-6-14-22-15-16(18-9-4-5-10-19(18)22)11-12-20(23)24-17-7-2-1-3-8-17/h1-5,7-12,15H,6,14H2/b12-11+