3-[(2S)-2-(4-chlorophenyl)-2-isocyanato-ethyl]pyridine

Systemtic Name: 3-[(2S)-2-(4-chlorophenyl)-2-isocyanato-ethyl]pyridine Openeye Name: 3-[(2S)-2-(4-chlorophenyl)-2-isocyanato-ethyl]pyridine CAS Name: 3-[(2S)-2-(4-chlorophenyl)-2-isocyanatoethyl]pyridine IUPAC Name: 3-[(2S)-2-(4-chlorophenyl)-2-isocyanatoethyl]pyridine Traditional Name: 3-[(2S)-2-(4-chlorophenyl)-2-isocyanato-ethyl]pyridine Formula: C14H11ClN2O MolecularWeight: 258.70294

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CC(C2=CC=C(C=C2)Cl)N=C=O

Isomeric SMILES

C1=CC(=CN=C1)C[C@@H](C2=CC=C(C=C2)Cl)N=C=O

InChI

InChI=1S/C14H11ClN2O/c15-13-5-3-12(4-6-13)14(17-10-18)8-11-2-1-7-16-9-11/h1-7,9,14H,8H2/t14-/m0/s1