ethyl (E)-3-(4-chloranyl-2-isocyanato-phenyl)prop-2-enoate

Systemtic Name: ethyl (E)-3-(4-chloranyl-2-isocyanato-phenyl)prop-2-enoate Openeye Name: ethyl (E)-3-(4-chloro-2-isocyanato-phenyl)prop-2-enoate CAS Name: (E)-3-(4-chloro-2-isocyanatophenyl)-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-(4-chloro-2-isocyanatophenyl)prop-2-enoate Traditional Name: (E)-3-(4-chloro-2-isocyanato-phenyl)acrylic acid ethyl ester Formula: C12H10ClNO3 MolecularWeight: 251.6657

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC1=C(C=C(C=C1)Cl)N=C=O

Isomeric SMILES

CCOC(=O)/C=C/C1=C(C=C(C=C1)Cl)N=C=O

InChI

InChI=1S/C12H10ClNO3/c1-2-17-12(16)6-4-9-3-5-10(13)7-11(9)14-8-15/h3-7H,2H2,1H3/b6-4+