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(phenylmethyl) 4-isocyanatobutanoate

(phenylmethyl) 4-isocyanatobutanoate

Systemtic Name:(phenylmethyl) 4-isocyanatobutanoate
Openeye Name:benzyl 4-isocyanatobutanoate
CAS Name:4-isocyanatobutanoic acid (phenylmethyl) ester
IUPAC Name:benzyl 4-isocyanatobutanoate
Traditional Name:4-isocyanatobutyric acid benzyl ester
Formula: C12H13NO3
MolecularWeight: 219.23652
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)CCCN=C=O


Isomeric SMILES

C1=CC=C(C=C1)COC(=O)CCCN=C=O


InChI

InChI=1S/C12H13NO3/c14-10-13-8-4-7-12(15)16-9-11-5-2-1-3-6-11/h1-3,5-6H,4,7-9H2


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