2-[3-[(E)-2-cyanoethenyl]-5-phenylmethoxy-indol-1-yl]-N-methyl-N-phenethyl-ethanamide

Systemtic Name: 2-[3-[(E)-2-cyanoethenyl]-5-phenylmethoxy-indol-1-yl]-N-methyl-N-phenethyl-ethanamide Openeye Name: 2-[5-benzyloxy-3-[(E)-2-cyanovinyl]indol-1-yl]-N-methyl-N-phenethyl-acetamide CAS Name: 2-[3-[(E)-2-cyanoethenyl]-5-phenylmethoxy-1-indolyl]-N-methyl-N-phenethylacetamide IUPAC Name: 2-[3-[(E)-2-cyanoethenyl]-5-phenylmethoxyindol-1-yl]-N-methyl-N-phenethylacetamide Traditional Name: 2-[5-benzoxy-3-[(E)-2-cyanovinyl]indol-1-yl]-N-methyl-N-phenethyl-acetamide Formula: C29H27N3O2 MolecularWeight: 449.54358

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC=CC=C1)C(=O)CN2C=C(C3=C2C=CC(=C3)OCC4=CC=CC=C4)C=CC#N

Isomeric SMILES

CN(CCC1=CC=CC=C1)C(=O)CN2C=C(C3=C2C=CC(=C3)OCC4=CC=CC=C4)/C=C/C#N

InChI

InChI=1S/C29H27N3O2/c1-31(18-16-23-9-4-2-5-10-23)29(33)21-32-20-25(13-8-17-30)27-19-26(14-15-28(27)32)34-22-24-11-6-3-7-12-24/h2-15,19-20H,16,18,21-22H2,1H3/b13-8+