[4-[6-(aminomethyl)-4-oxidanylidene-1H-pyrimidin-2-yl]phenyl]methyl-[(1R)-2-methoxy-1-pyridin-2-yl-ethyl]-methyl-azanium

Systemtic Name: [4-[6-(aminomethyl)-4-oxidanylidene-1H-pyrimidin-2-yl]phenyl]methyl-[(1R)-2-methoxy-1-pyridin-2-yl-ethyl]-methyl-azanium Openeye Name: [4-[6-(aminomethyl)-4-oxo-1H-pyrimidin-2-yl]phenyl]methyl-[(1R)-2-methoxy-1-(2-pyridyl)ethyl]-methyl-ammonium CAS Name: [4-[6-(aminomethyl)-4-oxo-1H-pyrimidin-2-yl]phenyl]methyl-[(1R)-2-methoxy-1-(2-pyridinyl)ethyl]-methylammonium IUPAC Name: [4-[6-(aminomethyl)-4-oxo-1H-pyrimidin-2-yl]phenyl]methyl-[(1R)-2-methoxy-1-pyridin-2-ylethyl]-methylazanium Traditional Name: [4-[6-(aminomethyl)-4-keto-1H-pyrimidin-2-yl]benzyl]-[(1R)-2-methoxy-1-(2-pyridyl)ethyl]-methyl-ammonium Formula: C21H26N5O2+ MolecularWeight: 380.46344

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=C(C=C1)C2=NC(=O)C=C(N2)CN)C(COC)C3=CC=CC=N3

Isomeric SMILES

C[NH+](CC1=CC=C(C=C1)C2=NC(=O)C=C(N2)CN)[C@@H](COC)C3=CC=CC=N3

InChI

InChI=1S/C21H25N5O2/c1-26(19(14-28-2)18-5-3-4-10-23-18)13-15-6-8-16(9-7-15)21-24-17(12-22)11-20(27)25-21/h3-11,19H,12-14,22H2,1-2H3,(H,24,25,27)/p+1/t19-/m0/s1