4-[1-[(1-butyl-1,2,3,4-tetrazol-5-yl)methyl]piperidin-1-ium-4-yl]phenol

Systemtic Name: 4-[1-[(1-butyl-1,2,3,4-tetrazol-5-yl)methyl]piperidin-1-ium-4-yl]phenol Openeye Name: 4-[1-[(1-butyltetrazol-5-yl)methyl]piperidin-1-ium-4-yl]phenol CAS Name: 4-[1-[(1-butyl-5-tetrazolyl)methyl]-4-piperidin-1-iumyl]phenol IUPAC Name: 4-[1-[(1-butyltetrazol-5-yl)methyl]piperidin-1-ium-4-yl]phenol Traditional Name: 4-[1-[(1-butyltetrazol-5-yl)methyl]piperidin-1-ium-4-yl]phenol Formula: C17H26N5O+ MolecularWeight: 316.42124

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=NN=N1)C[NH+]2CCC(CC2)C3=CC=C(C=C3)O

Isomeric SMILES

CCCCN1C(=NN=N1)C[NH+]2CCC(CC2)C3=CC=C(C=C3)O

InChI

InChI=1S/C17H25N5O/c1-2-3-10-22-17(18-19-20-22)13-21-11-8-15(9-12-21)14-4-6-16(23)7-5-14/h4-7,15,23H,2-3,8-13H2,1H3/p+1