[3,4-bis(oxidanyl)phenyl]methyl-[2-(4-methoxyphenyl)ethyl]azanium

Systemtic Name: [3,4-bis(oxidanyl)phenyl]methyl-[2-(4-methoxyphenyl)ethyl]azanium Openeye Name: (3,4-dihydroxyphenyl)methyl-[2-(4-methoxyphenyl)ethyl]ammonium CAS Name: (3,4-dihydroxyphenyl)methyl-[2-(4-methoxyphenyl)ethyl]ammonium IUPAC Name: (3,4-dihydroxyphenyl)methyl-[2-(4-methoxyphenyl)ethyl]azanium Traditional Name: 2-(4-methoxyphenyl)ethyl-protocatechuyl-ammonium Formula: C16H20NO3+ MolecularWeight: 274.3349

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC[NH2+]CC2=CC(=C(C=C2)O)O

Isomeric SMILES

COC1=CC=C(C=C1)CC[NH2+]CC2=CC(=C(C=C2)O)O

InChI

InChI=1S/C16H19NO3/c1-20-14-5-2-12(3-6-14)8-9-17-11-13-4-7-15(18)16(19)10-13/h2-7,10,17-19H,8-9,11H2,1H3/p+1