1-[(2S)-1-phenylpent-3-yn-2-yl]benzotriazole

Systemtic Name: 1-[(2S)-1-phenylpent-3-yn-2-yl]benzotriazole Openeye Name: 1-[(1S)-1-benzylbut-2-ynyl]benzotriazole CAS Name: 1-[(2S)-1-phenylpent-3-yn-2-yl]benzotriazole IUPAC Name: 1-[(2S)-1-phenylpent-3-yn-2-yl]benzotriazole Traditional Name: 1-[(1S)-1-benzylbut-2-ynyl]benzotriazole Formula: C17H15N3 MolecularWeight: 261.3211

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Descriptors Computed from Structure

Canonical SMILES:

CC#CC(CC1=CC=CC=C1)N2C3=CC=CC=C3N=N2

Isomeric SMILES

CC#C[C@H](CC1=CC=CC=C1)N2C3=CC=CC=C3N=N2

InChI

InChI=1S/C17H15N3/c1-2-8-15(13-14-9-4-3-5-10-14)20-17-12-7-6-11-16(17)18-19-20/h3-7,9-12,15H,13H2,1H3/t15-/m1/s1