(4-propylphenyl) 6-isocyanatohexanoate

Systemtic Name: (4-propylphenyl) 6-isocyanatohexanoate Openeye Name: (4-propylphenyl) 6-isocyanatohexanoate CAS Name: 6-isocyanatohexanoic acid (4-propylphenyl) ester IUPAC Name: (4-propylphenyl) 6-isocyanatohexanoate Traditional Name: 6-isocyanatohexanoic acid (4-propylphenyl) ester Formula: C16H21NO3 MolecularWeight: 275.34284

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)OC(=O)CCCCCN=C=O

Isomeric SMILES

CCCC1=CC=C(C=C1)OC(=O)CCCCCN=C=O

InChI

InChI=1S/C16H21NO3/c1-2-6-14-8-10-15(11-9-14)20-16(19)7-4-3-5-12-17-13-18/h8-11H,2-7,12H2,1H3