[4-azanyl-5-[(3,4,5-trimethoxyphenyl)methyl]-5H-pyrimidin-1-ium-2-ylidene]azanium

Systemtic Name: [4-azanyl-5-[(3,4,5-trimethoxyphenyl)methyl]-5H-pyrimidin-1-ium-2-ylidene]azanium Openeye Name: [4-amino-5-[(3,4,5-trimethoxyphenyl)methyl]-5H-pyrimidin-1-ium-2-ylidene]ammonium CAS Name: [4-amino-5-[(3,4,5-trimethoxyphenyl)methyl]-5H-pyrimidin-1-ium-2-ylidene]ammonium IUPAC Name: [4-amino-5-[(3,4,5-trimethoxyphenyl)methyl]-5H-pyrimidin-1-ium-2-ylidene]azanium Traditional Name: [4-amino-5-(3,4,5-trimethoxybenzyl)-5H-pyrimidin-1-ium-2-ylidene]ammonium Formula: C14H20N4O3+2 MolecularWeight: 292.3336

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)CC2C=[NH+]C(=[NH2+])N=C2N

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)CC2C=[NH+]C(=[NH2+])N=C2N

InChI

InChI=1S/C14H18N4O3/c1-19-10-5-8(6-11(20-2)12(10)21-3)4-9-7-17-14(16)18-13(9)15/h5-7,9H,4H2,1-3H3,(H3,15,16,18)/p+2