(3-chlorophenyl)-(6,7-dimethoxyquinazolin-4-yl)-oxidanyl-(pyridin-4-ylmethyl)azanium

Systemtic Name: (3-chlorophenyl)-(6,7-dimethoxyquinazolin-4-yl)-oxidanyl-(pyridin-4-ylmethyl)azanium Openeye Name: (3-chlorophenyl)-(6,7-dimethoxyquinazolin-4-yl)-hydroxy-(4-pyridylmethyl)ammonium CAS Name: (3-chlorophenyl)-(6,7-dimethoxy-4-quinazolinyl)-hydroxy-(pyridin-4-ylmethyl)ammonium IUPAC Name: (3-chlorophenyl)-(6,7-dimethoxyquinazolin-4-yl)-hydroxy-(pyridin-4-ylmethyl)azanium Traditional Name: (3-chlorophenyl)-(6,7-dimethoxyquinazolin-4-yl)-hydroxy-(4-pyridylmethyl)ammonium Formula: C22H20ClN4O3+ MolecularWeight: 423.8722

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC=N2)[N+](CC3=CC=NC=C3)(C4=CC(=CC=C4)Cl)O)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC=N2)[N+](CC3=CC=NC=C3)(C4=CC(=CC=C4)Cl)O)OC

InChI

InChI=1S/C22H20ClN4O3/c1-29-20-11-18-19(12-21(20)30-2)25-14-26-22(18)27(28,13-15-6-8-24-9-7-15)17-5-3-4-16(23)10-17/h3-12,14,28H,13H2,1-2H3/q+1