(E)-3-(3,5-ditert-butyl-4-oxidanyl-phenyl)-2-[(2-methyl-1H-indol-3-yl)carbonyl]prop-2-enenitrile

Systemtic Name: (E)-3-(3,5-ditert-butyl-4-oxidanyl-phenyl)-2-[(2-methyl-1H-indol-3-yl)carbonyl]prop-2-enenitrile Openeye Name: (E)-3-(3,5-ditert-butyl-4-hydroxy-phenyl)-2-(2-methyl-1H-indole-3-carbonyl)prop-2-enenitrile CAS Name: (E)-3-(3,5-ditert-butyl-4-hydroxyphenyl)-2-[(2-methyl-1H-indol-3-yl)-oxomethyl]-2-propenenitrile IUPAC Name: (E)-3-(3,5-ditert-butyl-4-hydroxyphenyl)-2-(2-methyl-1H-indole-3-carbonyl)prop-2-enenitrile Traditional Name: (E)-3-(3,5-ditert-butyl-4-hydroxy-phenyl)-2-(2-methyl-1H-indole-3-carbonyl)acrylonitrile Formula: C27H30N2O2 MolecularWeight: 414.5393

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1)C(=O)C(=CC3=CC(=C(C(=C3)C(C)(C)C)O)C(C)(C)C)C#N

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1)C(=O)/C(=C/C3=CC(=C(C(=C3)C(C)(C)C)O)C(C)(C)C)/C#N

InChI

InChI=1S/C27H30N2O2/c1-16-23(19-10-8-9-11-22(19)29-16)24(30)18(15-28)12-17-13-20(26(2,3)4)25(31)21(14-17)27(5,6)7/h8-14,29,31H,1-7H3/b18-12+