[(2R)-3-[2-methoxy-5-[[(5-methylpyrazin-2-yl)methylazaniumyl]methyl]phenoxy]-2-oxidanyl-propyl]-methyl-propan-2-yl-azanium

Systemtic Name: [(2R)-3-[2-methoxy-5-[[(5-methylpyrazin-2-yl)methylazaniumyl]methyl]phenoxy]-2-oxidanyl-propyl]-methyl-propan-2-yl-azanium Openeye Name: [(2R)-2-hydroxy-3-[2-methoxy-5-[[(5-methylpyrazin-2-yl)methylammonio]methyl]phenoxy]propyl]-isopropyl-methyl-ammonium CAS Name: [(2R)-2-hydroxy-3-[2-methoxy-5-[[(5-methyl-2-pyrazinyl)methylammonio]methyl]phenoxy]propyl]-methyl-propan-2-ylammonium IUPAC Name: [(2R)-2-hydroxy-3-[2-methoxy-5-[[(5-methylpyrazin-2-yl)methylazaniumyl]methyl]phenoxy]propyl]-methyl-propan-2-ylazanium Traditional Name: [(2R)-2-hydroxy-3-[2-methoxy-5-[[(5-methylpyrazin-2-yl)methylammonio]methyl]phenoxy]propyl]-isopropyl-methyl-ammonium Formula: C21H34N4O3+2 MolecularWeight: 390.51966

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C=N1)C[NH2+]CC2=CC(=C(C=C2)OC)OCC(C[NH+](C)C(C)C)O

Isomeric SMILES

CC1=CN=C(C=N1)C[NH2+]CC2=CC(=C(C=C2)OC)OC[C@@H](C[NH+](C)C(C)C)O

InChI

InChI=1S/C21H32N4O3/c1-15(2)25(4)13-19(26)14-28-21-8-17(6-7-20(21)27-5)10-22-11-18-12-23-16(3)9-24-18/h6-9,12,15,19,22,26H,10-11,13-14H2,1-5H3/p+2/t19-/m1/s1