3-oxidanyl-2-[(2-phenylquinazolin-3-ium-4-yl)amino]propanoic acid chloride

Systemtic Name: 3-oxidanyl-2-[(2-phenylquinazolin-3-ium-4-yl)amino]propanoic acid chloride Openeye Name: 3-hydroxy-2-[(2-phenylquinazolin-3-ium-4-yl)amino]propanoic acid chloride CAS Name: 3-hydroxy-2-[(2-phenyl-4-quinazolin-3-iumyl)amino]propanoic acid chloride IUPAC Name: 3-hydroxy-2-[(2-phenylquinazolin-3-ium-4-yl)amino]propanoic acid chloride Traditional Name: 3-hydroxy-2-[(2-phenylquinazolin-3-ium-4-yl)amino]propionic acid chloride Formula: C17H16ClN3O3 MolecularWeight: 345.78024

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=[NH+]2)NC(CO)C(=O)O.[Cl-]

Isomeric SMILES

C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=[NH+]2)NC(CO)C(=O)O.[Cl-]

InChI

InChI=1S/C17H15N3O3.ClH/c21-10-14(17(22)23)19-16-12-8-4-5-9-13(12)18-15(20-16)11-6-2-1-3-7-11;/h1-9,14,21H,10H2,(H,22,23)(H,18,19,20);1H