ethyl (Z)-3-(4-ethylphenyl)-2-isocyanato-prop-2-enoate

Systemtic Name: ethyl (Z)-3-(4-ethylphenyl)-2-isocyanato-prop-2-enoate Openeye Name: ethyl (Z)-3-(4-ethylphenyl)-2-isocyanato-prop-2-enoate CAS Name: (Z)-3-(4-ethylphenyl)-2-isocyanato-2-propenoic acid ethyl ester IUPAC Name: ethyl (Z)-3-(4-ethylphenyl)-2-isocyanatoprop-2-enoate Traditional Name: (Z)-3-(4-ethylphenyl)-2-isocyanato-acrylic acid ethyl ester Formula: C14H15NO3 MolecularWeight: 245.2738

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C=C(C(=O)OCC)N=C=O

Isomeric SMILES

CCC1=CC=C(C=C1)/C=C(/C(=O)OCC)\N=C=O

InChI

InChI=1S/C14H15NO3/c1-3-11-5-7-12(8-6-11)9-13(15-10-16)14(17)18-4-2/h5-9H,3-4H2,1-2H3/b13-9-