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

Systemtic Name: methyl-[3-[(4-oxidanyl-2-oxidanylidene-3-phenyl-1H-quinazolin-4-yl)carbonylamino]propyl]-(phenylmethyl)azanium Openeye Name: benzyl-[3-[(4-hydroxy-2-oxo-3-phenyl-1H-quinazoline-4-carbonyl)amino]propyl]-methyl-ammonium CAS Name: 3-[[(4-hydroxy-2-oxo-3-phenyl-1H-quinazolin-4-yl)-oxomethyl]amino]propyl-methyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[3-[(4-hydroxy-2-oxo-3-phenyl-1H-quinazoline-4-carbonyl)amino]propyl]-methylazanium Traditional Name: benzyl-[3-[(4-hydroxy-2-keto-3-phenyl-1H-quinazoline-4-carbonyl)amino]propyl]-methyl-ammonium Formula: C26H29N4O3+ MolecularWeight: 445.53346

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H28N4O3/c1-29(19-20-11-4-2-5-12-20)18-10-17-27-24(31)26(33)22-15-8-9-16-23(22)28-25(32)30(26)21-13-6-3-7-14-21/h2-9,11-16,33H,10,17-19H2,1H3,(H,27,31)(H,28,32)/p+1