2,3-dihydro-1,4-benzodioxin-6-ylmethyl-[(2R)-2-(4-methoxyphenyl)-2-morpholin-4-ium-4-yl-ethyl]azanium

Systemtic Name: 2,3-dihydro-1,4-benzodioxin-6-ylmethyl-[(2R)-2-(4-methoxyphenyl)-2-morpholin-4-ium-4-yl-ethyl]azanium Openeye Name: 2,3-dihydro-1,4-benzodioxin-6-ylmethyl-[(2R)-2-(4-methoxyphenyl)-2-morpholin-4-ium-4-yl-ethyl]ammonium CAS Name: 2,3-dihydro-1,4-benzodioxin-6-ylmethyl-[(2R)-2-(4-methoxyphenyl)-2-(4-morpholin-4-iumyl)ethyl]ammonium IUPAC Name: 2,3-dihydro-1,4-benzodioxin-6-ylmethyl-[(2R)-2-(4-methoxyphenyl)-2-morpholin-4-ium-4-ylethyl]azanium Traditional Name: 2,3-dihydro-1,4-benzodioxin-6-ylmethyl-[(2R)-2-(4-methoxyphenyl)-2-morpholin-4-ium-4-yl-ethyl]ammonium Formula: C22H30N2O4+2 MolecularWeight: 386.4846

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(C[NH2+]CC2=CC3=C(C=C2)OCCO3)[NH+]4CCOCC4

Isomeric SMILES

COC1=CC=C(C=C1)[C@H](C[NH2+]CC2=CC3=C(C=C2)OCCO3)[NH+]4CCOCC4

InChI

InChI=1S/C22H28N2O4/c1-25-19-5-3-18(4-6-19)20(24-8-10-26-11-9-24)16-23-15-17-2-7-21-22(14-17)28-13-12-27-21/h2-7,14,20,23H,8-13,15-16H2,1H3/p+2/t20-/m0/s1