[4-[[4-(phenylmethyl)piperidin-1-ium-1-yl]methyl]-1,3-thiazol-2-yl]methylazanium

Systemtic Name: [4-[[4-(phenylmethyl)piperidin-1-ium-1-yl]methyl]-1,3-thiazol-2-yl]methylazanium Openeye Name: [4-[(4-benzylpiperidin-1-ium-1-yl)methyl]thiazol-2-yl]methylammonium CAS Name: [4-[[4-(phenylmethyl)-1-piperidin-1-iumyl]methyl]-2-thiazolyl]methylammonium IUPAC Name: [4-[(4-benzylpiperidin-1-ium-1-yl)methyl]-1,3-thiazol-2-yl]methylazanium Traditional Name: [4-[(4-benzylpiperidin-1-ium-1-yl)methyl]thiazol-2-yl]methylammonium Formula: C17H25N3S+2 MolecularWeight: 303.4655

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1CC2=CC=CC=C2)CC3=CSC(=N3)C[NH3+]

Isomeric SMILES

C1C[NH+](CCC1CC2=CC=CC=C2)CC3=CSC(=N3)C[NH3+]

InChI

InChI=1S/C17H23N3S/c18-11-17-19-16(13-21-17)12-20-8-6-15(7-9-20)10-14-4-2-1-3-5-14/h1-5,13,15H,6-12,18H2/p+2