methyl-[2-[(4-oxidanyl-2-oxidanylidene-3-phenyl-1H-quinazolin-4-yl)carbonylamino]ethyl]-(phenylmethyl)azanium

Systemtic Name: methyl-[2-[(4-oxidanyl-2-oxidanylidene-3-phenyl-1H-quinazolin-4-yl)carbonylamino]ethyl]-(phenylmethyl)azanium Openeye Name: benzyl-[2-[(4-hydroxy-2-oxo-3-phenyl-1H-quinazoline-4-carbonyl)amino]ethyl]-methyl-ammonium CAS Name: 2-[[(4-hydroxy-2-oxo-3-phenyl-1H-quinazolin-4-yl)-oxomethyl]amino]ethyl-methyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[2-[(4-hydroxy-2-oxo-3-phenyl-1H-quinazoline-4-carbonyl)amino]ethyl]-methylazanium Traditional Name: benzyl-[2-[(4-hydroxy-2-keto-3-phenyl-1H-quinazoline-4-carbonyl)amino]ethyl]-methyl-ammonium Formula: C25H27N4O3+ MolecularWeight: 431.50688

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCNC(=O)C1(C2=CC=CC=C2NC(=O)N1C3=CC=CC=C3)O)CC4=CC=CC=C4

Isomeric SMILES

C[NH+](CCNC(=O)C1(C2=CC=CC=C2NC(=O)N1C3=CC=CC=C3)O)CC4=CC=CC=C4

InChI

InChI=1S/C25H26N4O3/c1-28(18-19-10-4-2-5-11-19)17-16-26-23(30)25(32)21-14-8-9-15-22(21)27-24(31)29(25)20-12-6-3-7-13-20/h2-15,32H,16-18H2,1H3,(H,26,30)(H,27,31)/p+1