ethyl-[(6-oxidanyl-1,3-benzodioxol-5-yl)methyl]-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]azanium

Systemtic Name: ethyl-[(6-oxidanyl-1,3-benzodioxol-5-yl)methyl]-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]azanium Openeye Name: ethyl-[(6-hydroxy-1,3-benzodioxol-5-yl)methyl]-[(4-oxo-1H-quinazolin-2-yl)methyl]ammonium CAS Name: ethyl-[(6-hydroxy-1,3-benzodioxol-5-yl)methyl]-[(4-oxo-1H-quinazolin-2-yl)methyl]ammonium IUPAC Name: ethyl-[(6-hydroxy-1,3-benzodioxol-5-yl)methyl]-[(4-oxo-1H-quinazolin-2-yl)methyl]azanium Traditional Name: ethyl-[(6-hydroxy-1,3-benzodioxol-5-yl)methyl]-[(4-keto-1H-quinazolin-2-yl)methyl]ammonium Formula: C19H20N3O4+ MolecularWeight: 354.3798

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=CC2=C(C=C1O)OCO2)CC3=NC(=O)C4=CC=CC=C4N3

Isomeric SMILES

CC[NH+](CC1=CC2=C(C=C1O)OCO2)CC3=NC(=O)C4=CC=CC=C4N3

InChI

InChI=1S/C19H19N3O4/c1-2-22(9-12-7-16-17(8-15(12)23)26-11-25-16)10-18-20-14-6-4-3-5-13(14)19(24)21-18/h3-8,23H,2,9-11H2,1H3,(H,20,21,24)/p+1