(3-chloranyl-4-ethoxy-5-methoxy-phenyl)methyl-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]azanium

Systemtic Name: (3-chloranyl-4-ethoxy-5-methoxy-phenyl)methyl-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]azanium Openeye Name: (3-chloro-4-ethoxy-5-methoxy-phenyl)methyl-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]ammonium CAS Name: (3-chloro-4-ethoxy-5-methoxyphenyl)methyl-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]ammonium IUPAC Name: (3-chloro-4-ethoxy-5-methoxyphenyl)methyl-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]azanium Traditional Name: (3-chloro-4-ethoxy-5-methoxy-benzyl)-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]ammonium Formula: C19H23ClNO4+ MolecularWeight: 364.84322

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1Cl)C[NH2+]CC2COC3=CC=CC=C3O2)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1Cl)C[NH2+]C[C@H]2COC3=CC=CC=C3O2)OC

InChI

InChI=1S/C19H22ClNO4/c1-3-23-19-15(20)8-13(9-18(19)22-2)10-21-11-14-12-24-16-6-4-5-7-17(16)25-14/h4-9,14,21H,3,10-12H2,1-2H3/p+1/t14-/m0/s1