(6-chloranyl-4H-1,3-benzodioxin-8-yl)methyl-methyl-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]azanium

Systemtic Name: (6-chloranyl-4H-1,3-benzodioxin-8-yl)methyl-methyl-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]azanium Openeye Name: (6-chloro-4H-1,3-benzodioxin-8-yl)methyl-methyl-[(4-oxo-1H-quinazolin-2-yl)methyl]ammonium CAS Name: (6-chloro-4H-1,3-benzodioxin-8-yl)methyl-methyl-[(4-oxo-1H-quinazolin-2-yl)methyl]ammonium IUPAC Name: (6-chloro-4H-1,3-benzodioxin-8-yl)methyl-methyl-[(4-oxo-1H-quinazolin-2-yl)methyl]azanium Traditional Name: (6-chloro-4H-1,3-benzodioxin-8-yl)methyl-[(4-keto-1H-quinazolin-2-yl)methyl]-methyl-ammonium Formula: C19H19ClN3O3+ MolecularWeight: 372.82546

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=C2C(=CC(=C1)Cl)COCO2)CC3=NC(=O)C4=CC=CC=C4N3

Isomeric SMILES

C[NH+](CC1=C2C(=CC(=C1)Cl)COCO2)CC3=NC(=O)C4=CC=CC=C4N3

InChI

InChI=1S/C19H18ClN3O3/c1-23(8-12-6-14(20)7-13-10-25-11-26-18(12)13)9-17-21-16-5-3-2-4-15(16)19(24)22-17/h2-7H,8-11H2,1H3,(H,21,22,24)/p+1