ethyl (E)-3-[1-[phenyl(pyridin-3-yl)methyl]indol-5-yl]but-2-enoate

Systemtic Name: ethyl (E)-3-[1-[phenyl(pyridin-3-yl)methyl]indol-5-yl]but-2-enoate Openeye Name: ethyl (E)-3-[1-[phenyl(3-pyridyl)methyl]indol-5-yl]but-2-enoate CAS Name: (E)-3-[1-[phenyl(3-pyridinyl)methyl]-5-indolyl]-2-butenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[1-[phenyl(pyridin-3-yl)methyl]indol-5-yl]but-2-enoate Traditional Name: (E)-3-[1-[phenyl(3-pyridyl)methyl]indol-5-yl]but-2-enoic acid ethyl ester Formula: C26H24N2O2 MolecularWeight: 396.48096

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=C(C)C1=CC2=C(C=C1)N(C=C2)C(C3=CC=CC=C3)C4=CN=CC=C4

Isomeric SMILES

CCOC(=O)/C=C(\C)/C1=CC2=C(C=C1)N(C=C2)C(C3=CC=CC=C3)C4=CN=CC=C4

InChI

InChI=1S/C26H24N2O2/c1-3-30-25(29)16-19(2)21-11-12-24-22(17-21)13-15-28(24)26(20-8-5-4-6-9-20)23-10-7-14-27-18-23/h4-18,26H,3H2,1-2H3/b19-16+