(3-methoxy-4-oxidanyl-phenyl)methyl-[(2R)-1-[(3-methoxy-4-oxidanyl-phenyl)methylazaniumyl]propan-2-yl]azanium

Systemtic Name: (3-methoxy-4-oxidanyl-phenyl)methyl-[(2R)-1-[(3-methoxy-4-oxidanyl-phenyl)methylazaniumyl]propan-2-yl]azanium Openeye Name: (4-hydroxy-3-methoxy-phenyl)methyl-[(1R)-2-[(4-hydroxy-3-methoxy-phenyl)methylammonio]-1-methyl-ethyl]ammonium CAS Name: (4-hydroxy-3-methoxyphenyl)methyl-[(2R)-1-[(4-hydroxy-3-methoxyphenyl)methylammonio]propan-2-yl]ammonium IUPAC Name: (4-hydroxy-3-methoxyphenyl)methyl-[(2R)-1-[(4-hydroxy-3-methoxyphenyl)methylazaniumyl]propan-2-yl]azanium Traditional Name: [(1R)-1-methyl-2-(vanillylammonio)ethyl]-vanillyl-ammonium Formula: C19H28N2O4+2 MolecularWeight: 348.43662

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Descriptors Computed from Structure

Canonical SMILES:

CC(C[NH2+]CC1=CC(=C(C=C1)O)OC)[NH2+]CC2=CC(=C(C=C2)O)OC

Isomeric SMILES

C[C@H](C[NH2+]CC1=CC(=C(C=C1)O)OC)[NH2+]CC2=CC(=C(C=C2)O)OC

InChI

InChI=1S/C19H26N2O4/c1-13(21-12-15-5-7-17(23)19(9-15)25-3)10-20-11-14-4-6-16(22)18(8-14)24-2/h4-9,13,20-23H,10-12H2,1-3H3/p+2/t13-/m1/s1