2-(2-oxidanyl-4-oxidanylidene-1-propyl-quinolin-1-ium-3-ylidene)-1H-quinazolin-4-one

Systemtic Name: 2-(2-oxidanyl-4-oxidanylidene-1-propyl-quinolin-1-ium-3-ylidene)-1H-quinazolin-4-one Openeye Name: 2-(2-hydroxy-4-oxo-1-propyl-quinolin-1-ium-3-ylidene)-1H-quinazolin-4-one CAS Name: 2-(2-hydroxy-4-oxo-1-propyl-3-quinolin-1-iumylidene)-1H-quinazolin-4-one IUPAC Name: 2-(2-hydroxy-4-oxo-1-propylquinolin-1-ium-3-ylidene)-1H-quinazolin-4-one Traditional Name: 2-(2-hydroxy-4-keto-1-propyl-quinolin-1-ium-3-ylidene)-1H-quinazolin-4-one Formula: C20H18N3O3+ MolecularWeight: 348.37522

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Descriptors Computed from Structure

Canonical SMILES:

CCC[N+]1=C(C(=C2NC3=CC=CC=C3C(=O)N2)C(=O)C4=CC=CC=C41)O

Isomeric SMILES

CCC[N+]1=C(C(=C2NC3=CC=CC=C3C(=O)N2)C(=O)C4=CC=CC=C41)O

InChI

InChI=1S/C20H17N3O3/c1-2-11-23-15-10-6-4-8-13(15)17(24)16(20(23)26)18-21-14-9-5-3-7-12(14)19(25)22-18/h3-10H,2,11H2,1H3,(H2,21,22,24,25,26)/p+1