(Z)-2-(4-tert-butylphenyl)carbonyl-3-[(2-fluoranyl-5-methyl-phenyl)amino]-3-oxidanyl-prop-2-enenitrile

Systemtic Name: (Z)-2-(4-tert-butylphenyl)carbonyl-3-[(2-fluoranyl-5-methyl-phenyl)amino]-3-oxidanyl-prop-2-enenitrile Openeye Name: (Z)-2-(4-tert-butylbenzoyl)-3-(2-fluoro-5-methyl-anilino)-3-hydroxy-prop-2-enenitrile CAS Name: (Z)-2-[(4-tert-butylphenyl)-oxomethyl]-3-(2-fluoro-5-methylanilino)-3-hydroxy-2-propenenitrile IUPAC Name: (Z)-2-(4-tert-butylbenzoyl)-3-(2-fluoro-5-methylanilino)-3-hydroxyprop-2-enenitrile Traditional Name: (Z)-2-(4-tert-butylbenzoyl)-3-(2-fluoro-5-methyl-anilino)-3-hydroxy-acrylonitrile Formula: C21H21FN2O2 MolecularWeight: 352.402043

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)F)NC(=C(C#N)C(=O)C2=CC=C(C=C2)C(C)(C)C)O

Isomeric SMILES

CC1=CC(=C(C=C1)F)N/C(=C(\C#N)/C(=O)C2=CC=C(C=C2)C(C)(C)C)/O

InChI

InChI=1S/C21H21FN2O2/c1-13-5-10-17(22)18(11-13)24-20(26)16(12-23)19(25)14-6-8-15(9-7-14)21(2,3)4/h5-11,24,26H,1-4H3/b20-16-