1-ethoxy-2-[(2S)-2-(4-fluorophenyl)-2-isocyanato-ethyl]benzene

Systemtic Name: 1-ethoxy-2-[(2S)-2-(4-fluorophenyl)-2-isocyanato-ethyl]benzene Openeye Name: 1-ethoxy-2-[(2S)-2-(4-fluorophenyl)-2-isocyanato-ethyl]benzene CAS Name: 1-ethoxy-2-[(2S)-2-(4-fluorophenyl)-2-isocyanatoethyl]benzene IUPAC Name: 1-ethoxy-2-[(2S)-2-(4-fluorophenyl)-2-isocyanatoethyl]benzene Traditional Name: 1-ethoxy-2-[(2S)-2-(4-fluorophenyl)-2-isocyanato-ethyl]benzene Formula: C17H16FNO2 MolecularWeight: 285.312843

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1CC(C2=CC=C(C=C2)F)N=C=O

Isomeric SMILES

CCOC1=CC=CC=C1C[C@@H](C2=CC=C(C=C2)F)N=C=O

InChI

InChI=1S/C17H16FNO2/c1-2-21-17-6-4-3-5-14(17)11-16(19-12-20)13-7-9-15(18)10-8-13/h3-10,16H,2,11H2,1H3/t16-/m0/s1