[3-methoxy-4-[(1-phenyl-1,2,3,4-tetrazol-5-yl)oxy]phenyl]methyl-propyl-azanium

Systemtic Name: [3-methoxy-4-[(1-phenyl-1,2,3,4-tetrazol-5-yl)oxy]phenyl]methyl-propyl-azanium Openeye Name: [3-methoxy-4-(1-phenyltetrazol-5-yl)oxy-phenyl]methyl-propyl-ammonium CAS Name: [3-methoxy-4-[(1-phenyl-5-tetrazolyl)oxy]phenyl]methyl-propylammonium IUPAC Name: [3-methoxy-4-(1-phenyltetrazol-5-yl)oxyphenyl]methyl-propylazanium Traditional Name: [3-methoxy-4-(1-phenyltetrazol-5-yl)oxy-benzyl]-propyl-ammonium Formula: C18H22N5O2+ MolecularWeight: 340.39958

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH2+]CC1=CC(=C(C=C1)OC2=NN=NN2C3=CC=CC=C3)OC

Isomeric SMILES

CCC[NH2+]CC1=CC(=C(C=C1)OC2=NN=NN2C3=CC=CC=C3)OC

InChI

InChI=1S/C18H21N5O2/c1-3-11-19-13-14-9-10-16(17(12-14)24-2)25-18-20-21-22-23(18)15-7-5-4-6-8-15/h4-10,12,19H,3,11,13H2,1-2H3/p+1