1-(5-isocyanato-2-phenylmethoxy-phenyl)ethanone

Systemtic Name: 1-(5-isocyanato-2-phenylmethoxy-phenyl)ethanone Openeye Name: 1-(2-benzyloxy-5-isocyanato-phenyl)ethanone CAS Name: 1-(5-isocyanato-2-phenylmethoxyphenyl)ethanone IUPAC Name: 1-(5-isocyanato-2-phenylmethoxyphenyl)ethanone Traditional Name: 1-(2-benzoxy-5-isocyanato-phenyl)ethanone Formula: C16H13NO3 MolecularWeight: 267.27932

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C=CC(=C1)N=C=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(=O)C1=C(C=CC(=C1)N=C=O)OCC2=CC=CC=C2

InChI

InChI=1S/C16H13NO3/c1-12(19)15-9-14(17-11-18)7-8-16(15)20-10-13-5-3-2-4-6-13/h2-9H,10H2,1H3