1-(5-chloranyl-4-methyl-2-phenylmethoxy-phenyl)-2-isocyano-ethanol

Systemtic Name: 1-(5-chloranyl-4-methyl-2-phenylmethoxy-phenyl)-2-isocyano-ethanol Openeye Name: 1-(2-benzyloxy-5-chloro-4-methyl-phenyl)-2-isocyano-ethanol CAS Name: 1-(5-chloro-4-methyl-2-phenylmethoxyphenyl)-2-isocyanoethanol IUPAC Name: 1-(5-chloro-4-methyl-2-phenylmethoxyphenyl)-2-isocyanoethanol Traditional Name: 1-(2-benzoxy-5-chloro-4-methyl-phenyl)-2-isocyano-ethanol Formula: C17H16ClNO2 MolecularWeight: 301.76744

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)C(C[N+]#[C-])O)OCC2=CC=CC=C2

Isomeric SMILES

CC1=CC(=C(C=C1Cl)C(C[N+]#[C-])O)OCC2=CC=CC=C2

InChI

InChI=1S/C17H16ClNO2/c1-12-8-17(21-11-13-6-4-3-5-7-13)14(9-15(12)18)16(20)10-19-2/h3-9,16,20H,10-11H2,1H3