1,3-benzodioxol-5-ylmethyl-methyl-[(1R)-1-(4-oxidanylidene-1H-quinazolin-2-yl)ethyl]azanium

Systemtic Name: 1,3-benzodioxol-5-ylmethyl-methyl-[(1R)-1-(4-oxidanylidene-1H-quinazolin-2-yl)ethyl]azanium Openeye Name: 1,3-benzodioxol-5-ylmethyl-methyl-[(1R)-1-(4-oxo-1H-quinazolin-2-yl)ethyl]ammonium CAS Name: 1,3-benzodioxol-5-ylmethyl-methyl-[(1R)-1-(4-oxo-1H-quinazolin-2-yl)ethyl]ammonium IUPAC Name: 1,3-benzodioxol-5-ylmethyl-methyl-[(1R)-1-(4-oxo-1H-quinazolin-2-yl)ethyl]azanium Traditional Name: [(1R)-1-(4-keto-1H-quinazolin-2-yl)ethyl]-methyl-piperonyl-ammonium Formula: C19H20N3O3+ MolecularWeight: 338.3804

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC(=O)C2=CC=CC=C2N1)[NH+](C)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C[C@H](C1=NC(=O)C2=CC=CC=C2N1)[NH+](C)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C19H19N3O3/c1-12(18-20-15-6-4-3-5-14(15)19(23)21-18)22(2)10-13-7-8-16-17(9-13)25-11-24-16/h3-9,12H,10-11H2,1-2H3,(H,20,21,23)/p+1/t12-/m1/s1