N,N-dimethyl-2-phenyl-quinazolin-3-ium-4-amine perchlorate

Systemtic Name: N,N-dimethyl-2-phenyl-quinazolin-3-ium-4-amine perchlorate Openeye Name: N,N-dimethyl-2-phenyl-quinazolin-3-ium-4-amine perchlorate CAS Name: N,N-dimethyl-2-phenyl-4-quinazolin-3-iumamine perchlorate IUPAC Name: N,N-dimethyl-2-phenylquinazolin-3-ium-4-amine perchlorate Traditional Name: dimethyl-(2-phenylquinazolin-3-ium-4-yl)amine perchlorate Formula: C16H16ClN3O4 MolecularWeight: 349.76894

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=[NH+]C(=NC2=CC=CC=C21)C3=CC=CC=C3.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CN(C)C1=[NH+]C(=NC2=CC=CC=C21)C3=CC=CC=C3.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C16H15N3.ClHO4/c1-19(2)16-13-10-6-7-11-14(13)17-15(18-16)12-8-4-3-5-9-12;2-1(3,4)5/h3-11H,1-2H3;(H,2,3,4,5)