(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl-cyclopropyl-[(4-propan-2-ylphenyl)methyl]azanium

Systemtic Name: (7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl-cyclopropyl-[(4-propan-2-ylphenyl)methyl]azanium Openeye Name: (7-chloro-4-oxo-1H-quinazolin-2-yl)methyl-cyclopropyl-[(4-isopropylphenyl)methyl]ammonium CAS Name: (7-chloro-4-oxo-1H-quinazolin-2-yl)methyl-cyclopropyl-[(4-propan-2-ylphenyl)methyl]ammonium IUPAC Name: (7-chloro-4-oxo-1H-quinazolin-2-yl)methyl-cyclopropyl-[(4-propan-2-ylphenyl)methyl]azanium Traditional Name: (7-chloro-4-keto-1H-quinazolin-2-yl)methyl-cyclopropyl-(4-isopropylbenzyl)ammonium Formula: C22H25ClN3O+ MolecularWeight: 382.9064

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C[NH+](CC2=NC(=O)C3=C(N2)C=C(C=C3)Cl)C4CC4

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C[NH+](CC2=NC(=O)C3=C(N2)C=C(C=C3)Cl)C4CC4

InChI

InChI=1S/C22H24ClN3O/c1-14(2)16-5-3-15(4-6-16)12-26(18-8-9-18)13-21-24-20-11-17(23)7-10-19(20)22(27)25-21/h3-7,10-11,14,18H,8-9,12-13H2,1-2H3,(H,24,25,27)/p+1