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

Systemtic Name: 4-[1-[(1-propyl-1,2,3,4-tetrazol-5-yl)methyl]piperidin-1-ium-4-yl]phenol Openeye Name: 4-[1-[(1-propyltetrazol-5-yl)methyl]piperidin-1-ium-4-yl]phenol CAS Name: 4-[1-[(1-propyl-5-tetrazolyl)methyl]-4-piperidin-1-iumyl]phenol IUPAC Name: 4-[1-[(1-propyltetrazol-5-yl)methyl]piperidin-1-ium-4-yl]phenol Traditional Name: 4-[1-[(1-propyltetrazol-5-yl)methyl]piperidin-1-ium-4-yl]phenol Formula: C16H24N5O+ MolecularWeight: 302.39466

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=NN=N1)C[NH+]2CCC(CC2)C3=CC=C(C=C3)O

Isomeric SMILES

CCCN1C(=NN=N1)C[NH+]2CCC(CC2)C3=CC=C(C=C3)O

InChI

InChI=1S/C16H23N5O/c1-2-9-21-16(17-18-19-21)12-20-10-7-14(8-11-20)13-3-5-15(22)6-4-13/h3-6,14,22H,2,7-12H2,1H3/p+1