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

Systemtic Name: 2-(1-hexyl-2-oxidanyl-4-oxidanylidene-quinolin-1-ium-3-ylidene)-1H-quinazolin-4-one Openeye Name: 2-(1-hexyl-2-hydroxy-4-oxo-quinolin-1-ium-3-ylidene)-1H-quinazolin-4-one CAS Name: 2-(1-hexyl-2-hydroxy-4-oxo-3-quinolin-1-iumylidene)-1H-quinazolin-4-one IUPAC Name: 2-(1-hexyl-2-hydroxy-4-oxoquinolin-1-ium-3-ylidene)-1H-quinazolin-4-one Traditional Name: 2-(1-hexyl-2-hydroxy-4-keto-quinolin-1-ium-3-ylidene)-1H-quinazolin-4-one Formula: C23H24N3O3+ MolecularWeight: 390.45496

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H23N3O3/c1-2-3-4-9-14-26-18-13-8-6-11-16(18)20(27)19(23(26)29)21-24-17-12-7-5-10-15(17)22(28)25-21/h5-8,10-13H,2-4,9,14H2,1H3,(H2,24,25,27,28,29)/p+1