7-chloranyl-2-[[ethyl-[2-oxidanylidene-2-[(2-phenoxyphenyl)amino]ethyl]azaniumyl]methyl]quinazolin-4-olate

Systemtic Name: 7-chloranyl-2-[[ethyl-[2-oxidanylidene-2-[(2-phenoxyphenyl)amino]ethyl]azaniumyl]methyl]quinazolin-4-olate Openeye Name: 7-chloro-2-[[ethyl-[2-oxo-2-(2-phenoxyanilino)ethyl]ammonio]methyl]quinazolin-4-olate CAS Name: 7-chloro-2-[[ethyl-[2-oxo-2-(2-phenoxyanilino)ethyl]ammonio]methyl]-4-quinazolinolate IUPAC Name: 7-chloro-2-[[ethyl-[2-oxo-2-(2-phenoxyanilino)ethyl]azaniumyl]methyl]quinazolin-4-olate Traditional Name: 7-chloro-2-[[ethyl-[2-keto-2-(2-phenoxyanilino)ethyl]ammonio]methyl]quinazolin-4-olate Formula: C25H23ClN4O3 MolecularWeight: 462.92812

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=NC2=C(C=CC(=C2)Cl)C(=N1)[O-])CC(=O)NC3=CC=CC=C3OC4=CC=CC=C4

Isomeric SMILES

CC[NH+](CC1=NC2=C(C=CC(=C2)Cl)C(=N1)[O-])CC(=O)NC3=CC=CC=C3OC4=CC=CC=C4

InChI

InChI=1S/C25H23ClN4O3/c1-2-30(15-23-27-21-14-17(26)12-13-19(21)25(32)29-23)16-24(31)28-20-10-6-7-11-22(20)33-18-8-4-3-5-9-18/h3-14H,2,15-16H2,1H3,(H,28,31)(H,27,29,32)