(E)-2-cyano-3-[2-methyl-3-(phenylcarbonyl)indolizin-1-yl]-N-(phenylmethyl)prop-2-enamide

Systemtic Name: (E)-2-cyano-3-[2-methyl-3-(phenylcarbonyl)indolizin-1-yl]-N-(phenylmethyl)prop-2-enamide Openeye Name: (E)-3-(3-benzoyl-2-methyl-indolizin-1-yl)-N-benzyl-2-cyano-prop-2-enamide CAS Name: (E)-3-(3-benzoyl-2-methyl-1-indolizinyl)-2-cyano-N-(phenylmethyl)-2-propenamide IUPAC Name: (E)-3-(3-benzoyl-2-methylindolizin-1-yl)-N-benzyl-2-cyanoprop-2-enamide Traditional Name: (E)-3-(3-benzoyl-2-methyl-indolizin-1-yl)-N-benzyl-2-cyano-acrylamide Formula: C27H21N3O2 MolecularWeight: 419.47454

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N2C=CC=CC2=C1C=C(C#N)C(=O)NCC3=CC=CC=C3)C(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=C(N2C=CC=CC2=C1/C=C(\C#N)/C(=O)NCC3=CC=CC=C3)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C27H21N3O2/c1-19-23(16-22(17-28)27(32)29-18-20-10-4-2-5-11-20)24-14-8-9-15-30(24)25(19)26(31)21-12-6-3-7-13-21/h2-16H,18H2,1H3,(H,29,32)/b22-16+