4-(4-cyclopropyl-1,2,3-triazol-1-yl)-1-[(2S)-2-phenylpropyl]piperidin-1-ium

Systemtic Name: 4-(4-cyclopropyl-1,2,3-triazol-1-yl)-1-[(2S)-2-phenylpropyl]piperidin-1-ium Openeye Name: 4-(4-cyclopropyltriazol-1-yl)-1-[(2S)-2-phenylpropyl]piperidin-1-ium CAS Name: 4-(4-cyclopropyl-1-triazolyl)-1-[(2S)-2-phenylpropyl]piperidin-1-ium IUPAC Name: 4-(4-cyclopropyltriazol-1-yl)-1-[(2S)-2-phenylpropyl]piperidin-1-ium Traditional Name: 4-(4-cyclopropyltriazol-1-yl)-1-[(2S)-2-phenylpropyl]piperidin-1-ium Formula: C19H27N4+ MolecularWeight: 311.44448

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Descriptors Computed from Structure

Canonical SMILES:

CC(C[NH+]1CCC(CC1)N2C=C(N=N2)C3CC3)C4=CC=CC=C4

Isomeric SMILES

C[C@H](C[NH+]1CCC(CC1)N2C=C(N=N2)C3CC3)C4=CC=CC=C4

InChI

InChI=1S/C19H26N4/c1-15(16-5-3-2-4-6-16)13-22-11-9-18(10-12-22)23-14-19(20-21-23)17-7-8-17/h2-6,14-15,17-18H,7-13H2,1H3/p+1/t15-/m1/s1