1-[(2S)-2-isocyanopropyl]-4-(phenoxymethyl)-1,2,3-triazole

Systemtic Name: 1-[(2S)-2-isocyanopropyl]-4-(phenoxymethyl)-1,2,3-triazole Openeye Name: 1-[(2S)-2-isocyanopropyl]-4-(phenoxymethyl)triazole CAS Name: 1-[(2S)-2-isocyanopropyl]-4-(phenoxymethyl)triazole IUPAC Name: 1-[(2S)-2-isocyanopropyl]-4-(phenoxymethyl)triazole Traditional Name: 1-[(2S)-2-isocyanopropyl]-4-(phenoxymethyl)triazole Formula: C13H14N4O MolecularWeight: 242.27646

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1C=C(N=N1)COC2=CC=CC=C2)[N+]#[C-]

Isomeric SMILES

C[C@@H](CN1C=C(N=N1)COC2=CC=CC=C2)[N+]#[C-]

InChI

InChI=1S/C13H14N4O/c1-11(14-2)8-17-9-12(15-16-17)10-18-13-6-4-3-5-7-13/h3-7,9,11H,8,10H2,1H3/t11-/m0/s1