(E)-2-cyano-3-[1-[(4-methylphenyl)methyl]indol-3-yl]-N-(phenylmethyl)prop-2-enamide

Systemtic Name: (E)-2-cyano-3-[1-[(4-methylphenyl)methyl]indol-3-yl]-N-(phenylmethyl)prop-2-enamide Openeye Name: (E)-N-benzyl-2-cyano-3-[1-(p-tolylmethyl)indol-3-yl]prop-2-enamide CAS Name: (E)-2-cyano-3-[1-[(4-methylphenyl)methyl]-3-indolyl]-N-(phenylmethyl)-2-propenamide IUPAC Name: (E)-N-benzyl-2-cyano-3-[1-[(4-methylphenyl)methyl]indol-3-yl]prop-2-enamide Traditional Name: (E)-N-benzyl-2-cyano-3-[1-(4-methylbenzyl)indol-3-yl]acrylamide Formula: C27H23N3O MolecularWeight: 405.49102

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C=C(C3=CC=CC=C32)C=C(C#N)C(=O)NCC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)CN2C=C(C3=CC=CC=C32)/C=C(\C#N)/C(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C27H23N3O/c1-20-11-13-22(14-12-20)18-30-19-24(25-9-5-6-10-26(25)30)15-23(16-28)27(31)29-17-21-7-3-2-4-8-21/h2-15,19H,17-18H2,1H3,(H,29,31)/b23-15+