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

Systemtic Name: 3-[[3-(3,4-dichlorophenyl)-4-oxidanyl-2-oxidanylidene-1H-quinazolin-4-yl]carbonylamino]propyl-methyl-(phenylmethyl)azanium Openeye Name: benzyl-[3-[[3-(3,4-dichlorophenyl)-4-hydroxy-2-oxo-1H-quinazoline-4-carbonyl]amino]propyl]-methyl-ammonium CAS Name: 3-[[[3-(3,4-dichlorophenyl)-4-hydroxy-2-oxo-1H-quinazolin-4-yl]-oxomethyl]amino]propyl-methyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[3-[[3-(3,4-dichlorophenyl)-4-hydroxy-2-oxo-1H-quinazoline-4-carbonyl]amino]propyl]-methylazanium Traditional Name: benzyl-[3-[[3-(3,4-dichlorophenyl)-4-hydroxy-2-keto-1H-quinazoline-4-carbonyl]amino]propyl]-methyl-ammonium Formula: C26H27Cl2N4O3+ MolecularWeight: 514.42358

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H26Cl2N4O3/c1-31(17-18-8-3-2-4-9-18)15-7-14-29-24(33)26(35)20-10-5-6-11-23(20)30-25(34)32(26)19-12-13-21(27)22(28)16-19/h2-6,8-13,16,35H,7,14-15,17H2,1H3,(H,29,33)(H,30,34)/p+1