ethyl 2-isocyanato-3-[4-[(2-methylpropan-2-yl)oxy]phenyl]propanoate

Systemtic Name: ethyl 2-isocyanato-3-[4-[(2-methylpropan-2-yl)oxy]phenyl]propanoate Openeye Name: ethyl 3-(4-tert-butoxyphenyl)-2-isocyanato-propanoate CAS Name: 2-isocyanato-3-[4-[(2-methylpropan-2-yl)oxy]phenyl]propanoic acid ethyl ester IUPAC Name: ethyl 2-isocyanato-3-[4-[(2-methylpropan-2-yl)oxy]phenyl]propanoate Traditional Name: 3-(4-tert-butoxyphenyl)-2-isocyanato-propionic acid ethyl ester Formula: C16H21NO4 MolecularWeight: 291.34224

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21NO4/c1-5-20-15(19)14(17-11-18)10-12-6-8-13(9-7-12)21-16(2,3)4/h6-9,14H,5,10H2,1-4H3