ethyl (E)-2-[2-isocyanato-1-(3-prop-1-en-2-ylphenyl)propan-2-yl]but-2-enoate

Systemtic Name: ethyl (E)-2-[2-isocyanato-1-(3-prop-1-en-2-ylphenyl)propan-2-yl]but-2-enoate Openeye Name: ethyl (E)-2-[1-isocyanato-2-(3-isopropenylphenyl)-1-methyl-ethyl]but-2-enoate CAS Name: (E)-2-[2-isocyanato-1-[3-(1-methylethenyl)phenyl]propan-2-yl]-2-butenoic acid ethyl ester IUPAC Name: ethyl (E)-2-[2-isocyanato-1-(3-prop-1-en-2-ylphenyl)propan-2-yl]but-2-enoate Traditional Name: (E)-2-[1-isocyanato-2-(3-isopropenylphenyl)-1-methyl-ethyl]but-2-enoic acid ethyl ester Formula: C19H23NO3 MolecularWeight: 313.39082

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCOC(=O)/C(=C/C)/C(C)(CC1=CC=CC(=C1)C(=C)C)N=C=O

InChI

InChI=1S/C19H23NO3/c1-6-17(18(22)23-7-2)19(5,20-13-21)12-15-9-8-10-16(11-15)14(3)4/h6,8-11H,3,7,12H2,1-2,4-5H3/b17-6-