1-[4-(4-azanyl-6,7-dimethoxy-quinazolin-3-ium-2-yl)piperazin-1-yl]-2-methyl-2-phenoxy-propan-1-one chloride

Systemtic Name: 1-[4-(4-azanyl-6,7-dimethoxy-quinazolin-3-ium-2-yl)piperazin-1-yl]-2-methyl-2-phenoxy-propan-1-one chloride Openeye Name: 1-[4-(4-amino-6,7-dimethoxy-quinazolin-3-ium-2-yl)piperazin-1-yl]-2-methyl-2-phenoxy-propan-1-one chloride CAS Name: 1-[4-(4-amino-6,7-dimethoxy-2-quinazolin-3-iumyl)-1-piperazinyl]-2-methyl-2-phenoxy-1-propanone chloride IUPAC Name: 1-[4-(4-amino-6,7-dimethoxyquinazolin-3-ium-2-yl)piperazin-1-yl]-2-methyl-2-phenoxypropan-1-one chloride Traditional Name: 1-[4-(4-amino-6,7-dimethoxy-quinazolin-3-ium-2-yl)piperazino]-2-methyl-2-phenoxy-propan-1-one chloride Formula: C24H30ClN5O4 MolecularWeight: 487.9791

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)N1CCN(CC1)C2=NC3=CC(=C(C=C3C(=[NH+]2)N)OC)OC)OC4=CC=CC=C4.[Cl-]

Isomeric SMILES

CC(C)(C(=O)N1CCN(CC1)C2=NC3=CC(=C(C=C3C(=[NH+]2)N)OC)OC)OC4=CC=CC=C4.[Cl-]

InChI

InChI=1S/C24H29N5O4.ClH/c1-24(2,33-16-8-6-5-7-9-16)22(30)28-10-12-29(13-11-28)23-26-18-15-20(32-4)19(31-3)14-17(18)21(25)27-23;/h5-9,14-15H,10-13H2,1-4H3,(H2,25,26,27);1H