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

Systemtic Name: diethyl-[2-[(4-oxidanyl-2-oxidanylidene-3-phenyl-1H-quinazolin-4-yl)carbonylamino]ethyl]azanium Openeye Name: diethyl-[2-[(4-hydroxy-2-oxo-3-phenyl-1H-quinazoline-4-carbonyl)amino]ethyl]ammonium CAS Name: diethyl-[2-[[(4-hydroxy-2-oxo-3-phenyl-1H-quinazolin-4-yl)-oxomethyl]amino]ethyl]ammonium IUPAC Name: diethyl-[2-[(4-hydroxy-2-oxo-3-phenyl-1H-quinazoline-4-carbonyl)amino]ethyl]azanium Traditional Name: diethyl-[2-[(4-hydroxy-2-keto-3-phenyl-1H-quinazoline-4-carbonyl)amino]ethyl]ammonium Formula: C21H27N4O3+ MolecularWeight: 383.46408

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26N4O3/c1-3-24(4-2)15-14-22-19(26)21(28)17-12-8-9-13-18(17)23-20(27)25(21)16-10-6-5-7-11-16/h5-13,28H,3-4,14-15H2,1-2H3,(H,22,26)(H,23,27)/p+1