(4-bromophenyl)methyl-[(7-methoxycarbonyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl]-methyl-azanium

Systemtic Name: (4-bromophenyl)methyl-[(7-methoxycarbonyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl]-methyl-azanium Openeye Name: (4-bromophenyl)methyl-[(7-methoxycarbonyl-4-oxo-1H-quinazolin-2-yl)methyl]-methyl-ammonium CAS Name: (4-bromophenyl)methyl-[(7-methoxycarbonyl-4-oxo-1H-quinazolin-2-yl)methyl]-methylammonium IUPAC Name: (4-bromophenyl)methyl-[(7-methoxycarbonyl-4-oxo-1H-quinazolin-2-yl)methyl]-methylazanium Traditional Name: (4-bromobenzyl)-[(7-carbomethoxy-4-keto-1H-quinazolin-2-yl)methyl]-methyl-ammonium Formula: C19H19BrN3O3+ MolecularWeight: 417.27646

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=C(C=C1)Br)CC2=NC(=O)C3=C(N2)C=C(C=C3)C(=O)OC

Isomeric SMILES

C[NH+](CC1=CC=C(C=C1)Br)CC2=NC(=O)C3=C(N2)C=C(C=C3)C(=O)OC

InChI

InChI=1S/C19H18BrN3O3/c1-23(10-12-3-6-14(20)7-4-12)11-17-21-16-9-13(19(25)26-2)5-8-15(16)18(24)22-17/h3-9H,10-11H2,1-2H3,(H,21,22,24)/p+1