[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-[(4-imidazol-1-ylphenyl)methyl]azanium

Systemtic Name: [(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-[(4-imidazol-1-ylphenyl)methyl]azanium Openeye Name: [(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-[(4-imidazol-1-ylphenyl)methyl]ammonium CAS Name: [(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-[[4-(1-imidazolyl)phenyl]methyl]ammonium IUPAC Name: [(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-[(4-imidazol-1-ylphenyl)methyl]azanium Traditional Name: [(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-(4-imidazol-1-ylbenzyl)ammonium Formula: C19H20N3O2+ MolecularWeight: 322.381

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=CC=CC=C2O1)C[NH2+]CC3=CC=C(C=C3)N4C=CN=C4

Isomeric SMILES

C1[C@H](OC2=CC=CC=C2O1)C[NH2+]CC3=CC=C(C=C3)N4C=CN=C4

InChI

InChI=1S/C19H19N3O2/c1-2-4-19-18(3-1)23-13-17(24-19)12-21-11-15-5-7-16(8-6-15)22-10-9-20-14-22/h1-10,14,17,21H,11-13H2/p+1/t17-/m1/s1