methyl (E)-3-[[3-[(4-tert-butylphenyl)carbonylamino]phenyl]amino]-2-cyano-prop-2-enoate

Systemtic Name: methyl (E)-3-[[3-[(4-tert-butylphenyl)carbonylamino]phenyl]amino]-2-cyano-prop-2-enoate Openeye Name: methyl (E)-3-[3-[(4-tert-butylbenzoyl)amino]anilino]-2-cyano-prop-2-enoate CAS Name: (E)-3-[3-[[(4-tert-butylphenyl)-oxomethyl]amino]anilino]-2-cyano-2-propenoic acid methyl ester IUPAC Name: methyl (E)-3-[3-[(4-tert-butylbenzoyl)amino]anilino]-2-cyanoprop-2-enoate Traditional Name: (E)-3-[3-[(4-tert-butylbenzoyl)amino]anilino]-2-cyano-acrylic acid methyl ester Formula: C22H23N3O3 MolecularWeight: 377.43632

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=CC=CC(=C2)NC=C(C#N)C(=O)OC

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=CC=CC(=C2)N/C=C(\C#N)/C(=O)OC

InChI

InChI=1S/C22H23N3O3/c1-22(2,3)17-10-8-15(9-11-17)20(26)25-19-7-5-6-18(12-19)24-14-16(13-23)21(27)28-4/h5-12,14,24H,1-4H3,(H,25,26)/b16-14+