cyclohexyl-methyl-[[2-[[4-(4-oxidanylidenequinazolin-3-yl)phenyl]carbonylamino]phenyl]methyl]azanium

Systemtic Name: cyclohexyl-methyl-[[2-[[4-(4-oxidanylidenequinazolin-3-yl)phenyl]carbonylamino]phenyl]methyl]azanium Openeye Name: cyclohexyl-methyl-[[2-[[4-(4-oxoquinazolin-3-yl)benzoyl]amino]phenyl]methyl]ammonium CAS Name: cyclohexyl-methyl-[[2-[[oxo-[4-(4-oxo-3-quinazolinyl)phenyl]methyl]amino]phenyl]methyl]ammonium IUPAC Name: cyclohexyl-methyl-[[2-[[4-(4-oxoquinazolin-3-yl)benzoyl]amino]phenyl]methyl]azanium Traditional Name: cyclohexyl-[2-[[4-(4-ketoquinazolin-3-yl)benzoyl]amino]benzyl]-methyl-ammonium Formula: C29H31N4O2+ MolecularWeight: 467.58204

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=CC=C1NC(=O)C2=CC=C(C=C2)N3C=NC4=CC=CC=C4C3=O)C5CCCCC5

Isomeric SMILES

C[NH+](CC1=CC=CC=C1NC(=O)C2=CC=C(C=C2)N3C=NC4=CC=CC=C4C3=O)C5CCCCC5

InChI

InChI=1S/C29H30N4O2/c1-32(23-10-3-2-4-11-23)19-22-9-5-7-13-26(22)31-28(34)21-15-17-24(18-16-21)33-20-30-27-14-8-6-12-25(27)29(33)35/h5-9,12-18,20,23H,2-4,10-11,19H2,1H3,(H,31,34)/p+1