1-[(2S)-2-isocyano-3-methyl-butyl]-4-(phenoxymethyl)-1,2,3-triazole

Systemtic Name: 1-[(2S)-2-isocyano-3-methyl-butyl]-4-(phenoxymethyl)-1,2,3-triazole Openeye Name: 1-[(2S)-2-isocyano-3-methyl-butyl]-4-(phenoxymethyl)triazole CAS Name: 1-[(2S)-2-isocyano-3-methylbutyl]-4-(phenoxymethyl)triazole IUPAC Name: 1-[(2S)-2-isocyano-3-methylbutyl]-4-(phenoxymethyl)triazole Traditional Name: 1-[(2S)-2-isocyano-3-methyl-butyl]-4-(phenoxymethyl)triazole Formula: C15H18N4O MolecularWeight: 270.32962

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H18N4O/c1-12(2)15(16-3)10-19-9-13(17-18-19)11-20-14-7-5-4-6-8-14/h4-9,12,15H,10-11H2,1-2H3/t15-/m1/s1