(E)-3-[4-[2-(cyanomethylamino)-2-oxidanylidene-ethoxy]-3,5-dimethyl-phenyl]prop-2-enoate

Systemtic Name: (E)-3-[4-[2-(cyanomethylamino)-2-oxidanylidene-ethoxy]-3,5-dimethyl-phenyl]prop-2-enoate Openeye Name: (E)-3-[4-[2-(cyanomethylamino)-2-oxo-ethoxy]-3,5-dimethyl-phenyl]prop-2-enoate CAS Name: (E)-3-[4-[2-(cyanomethylamino)-2-oxoethoxy]-3,5-dimethylphenyl]-2-propenoate IUPAC Name: (E)-3-[4-[2-(cyanomethylamino)-2-oxoethoxy]-3,5-dimethylphenyl]prop-2-enoate Traditional Name: (E)-3-[4-[2-(cyanomethylamino)-2-keto-ethoxy]-3,5-dimethyl-phenyl]acrylate Formula: C15H15N2O4- MolecularWeight: 287.2906

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OCC(=O)NCC#N)C)C=CC(=O)[O-]

Isomeric SMILES

CC1=CC(=CC(=C1OCC(=O)NCC#N)C)/C=C/C(=O)[O-]

InChI

InChI=1S/C15H16N2O4/c1-10-7-12(3-4-14(19)20)8-11(2)15(10)21-9-13(18)17-6-5-16/h3-4,7-8H,6,9H2,1-2H3,(H,17,18)(H,19,20)/p-1/b4-3+