N-[1-(phenylmethyl)piperidin-1-ium-4-yl]-3-(1,2,4-triazol-1-yl)propanamide

Systemtic Name: N-[1-(phenylmethyl)piperidin-1-ium-4-yl]-3-(1,2,4-triazol-1-yl)propanamide Openeye Name: N-(1-benzylpiperidin-1-ium-4-yl)-3-(1,2,4-triazol-1-yl)propanamide CAS Name: N-[1-(phenylmethyl)-4-piperidin-1-iumyl]-3-(1,2,4-triazol-1-yl)propanamide IUPAC Name: N-(1-benzylpiperidin-1-ium-4-yl)-3-(1,2,4-triazol-1-yl)propanamide Traditional Name: N-(1-benzylpiperidin-1-ium-4-yl)-3-(1,2,4-triazol-1-yl)propionamide Formula: C17H24N5O+ MolecularWeight: 314.40536

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1NC(=O)CCN2C=NC=N2)CC3=CC=CC=C3

Isomeric SMILES

C1C[NH+](CCC1NC(=O)CCN2C=NC=N2)CC3=CC=CC=C3

InChI

InChI=1S/C17H23N5O/c23-17(8-11-22-14-18-13-19-22)20-16-6-9-21(10-7-16)12-15-4-2-1-3-5-15/h1-5,13-14,16H,6-12H2,(H,20,23)/p+1