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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)C(CC2=CN=CC=C2)N=C=O

Isomeric SMILES

C1=CC(=CC(=C1)Cl)[C@H](CC2=CN=CC=C2)N=C=O

InChI

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