[1-(4-methoxyphenyl)imidazol-2-yl]methyl-[(3S)-1-pyrimidin-2-ylpiperidin-3-yl]azanium

Systemtic Name: [1-(4-methoxyphenyl)imidazol-2-yl]methyl-[(3S)-1-pyrimidin-2-ylpiperidin-3-yl]azanium Openeye Name: [1-(4-methoxyphenyl)imidazol-2-yl]methyl-[(3S)-1-pyrimidin-2-yl-3-piperidyl]ammonium CAS Name: [1-(4-methoxyphenyl)-2-imidazolyl]methyl-[(3S)-1-(2-pyrimidinyl)-3-piperidinyl]ammonium IUPAC Name: [1-(4-methoxyphenyl)imidazol-2-yl]methyl-[(3S)-1-pyrimidin-2-ylpiperidin-3-yl]azanium Traditional Name: [1-(4-methoxyphenyl)imidazol-2-yl]methyl-[(3S)-1-(2-pyrimidyl)-3-piperidyl]ammonium Formula: C20H25N6O+ MolecularWeight: 365.4521

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C=CN=C2C[NH2+]C3CCCN(C3)C4=NC=CC=N4

Isomeric SMILES

COC1=CC=C(C=C1)N2C=CN=C2C[NH2+][C@H]3CCCN(C3)C4=NC=CC=N4

InChI

InChI=1S/C20H24N6O/c1-27-18-7-5-17(6-8-18)26-13-11-21-19(26)14-24-16-4-2-12-25(15-16)20-22-9-3-10-23-20/h3,5-11,13,16,24H,2,4,12,14-15H2,1H3/p+1/t16-/m0/s1