(2-benzamido-2-oxidanylidene-ethyl) (E)-3-[1-(2-cyanoethyl)indol-3-yl]prop-2-enoate

Systemtic Name: (2-benzamido-2-oxidanylidene-ethyl) (E)-3-[1-(2-cyanoethyl)indol-3-yl]prop-2-enoate Openeye Name: (2-benzamido-2-oxo-ethyl) (E)-3-[1-(2-cyanoethyl)indol-3-yl]prop-2-enoate CAS Name: (E)-3-[1-(2-cyanoethyl)-3-indolyl]-2-propenoic acid (2-benzamido-2-oxoethyl) ester IUPAC Name: (2-benzamido-2-oxoethyl) (E)-3-[1-(2-cyanoethyl)indol-3-yl]prop-2-enoate Traditional Name: (E)-3-[1-(2-cyanoethyl)indol-3-yl]acrylic acid (2-benzamido-2-keto-ethyl) ester Formula: C23H19N3O4 MolecularWeight: 401.41466

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H19N3O4/c24-13-6-14-26-15-18(19-9-4-5-10-20(19)26)11-12-22(28)30-16-21(27)25-23(29)17-7-2-1-3-8-17/h1-5,7-12,15H,6,14,16H2,(H,25,27,29)/b12-11+