diethyl-[(2R)-3-[2-methoxy-4-[[(1-methylpyrazol-4-yl)methylazaniumyl]methyl]phenoxy]-2-oxidanyl-propyl]azanium

Systemtic Name: diethyl-[(2R)-3-[2-methoxy-4-[[(1-methylpyrazol-4-yl)methylazaniumyl]methyl]phenoxy]-2-oxidanyl-propyl]azanium Openeye Name: diethyl-[(2R)-2-hydroxy-3-[2-methoxy-4-[[(1-methylpyrazol-4-yl)methylammonio]methyl]phenoxy]propyl]ammonium CAS Name: diethyl-[(2R)-2-hydroxy-3-[2-methoxy-4-[[(1-methyl-4-pyrazolyl)methylammonio]methyl]phenoxy]propyl]ammonium IUPAC Name: diethyl-[(2R)-2-hydroxy-3-[2-methoxy-4-[[(1-methylpyrazol-4-yl)methylazaniumyl]methyl]phenoxy]propyl]azanium Traditional Name: diethyl-[(2R)-2-hydroxy-3-[2-methoxy-4-[[(1-methylpyrazol-4-yl)methylammonio]methyl]phenoxy]propyl]ammonium Formula: C20H34N4O3+2 MolecularWeight: 378.50896

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC(COC1=C(C=C(C=C1)C[NH2+]CC2=CN(N=C2)C)OC)O

Isomeric SMILES

CC[NH+](CC)C[C@H](COC1=C(C=C(C=C1)C[NH2+]CC2=CN(N=C2)C)OC)O

InChI

InChI=1S/C20H32N4O3/c1-5-24(6-2)14-18(25)15-27-19-8-7-16(9-20(19)26-4)10-21-11-17-12-22-23(3)13-17/h7-9,12-13,18,21,25H,5-6,10-11,14-15H2,1-4H3/p+2/t18-/m1/s1