[(1R)-1-(4-tert-butylphenyl)-2-methyl-propyl]-[(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl]azanium

Systemtic Name: [(1R)-1-(4-tert-butylphenyl)-2-methyl-propyl]-[(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl]azanium Openeye Name: [(1R)-1-(4-tert-butylphenyl)-2-methyl-propyl]-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methyl]ammonium CAS Name: [(1R)-1-(4-tert-butylphenyl)-2-methylpropyl]-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methyl]ammonium IUPAC Name: [(1R)-1-(4-tert-butylphenyl)-2-methylpropyl]-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methyl]azanium Traditional Name: [(1R)-1-(4-tert-butylphenyl)-2-methyl-propyl]-[(7-chloro-4-keto-1H-quinazolin-2-yl)methyl]ammonium Formula: C23H29ClN3O+ MolecularWeight: 398.94886

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=CC=C(C=C1)C(C)(C)C)[NH2+]CC2=NC(=O)C3=C(N2)C=C(C=C3)Cl

Isomeric SMILES

CC(C)[C@H](C1=CC=C(C=C1)C(C)(C)C)[NH2+]CC2=NC(=O)C3=C(N2)C=C(C=C3)Cl

InChI

InChI=1S/C23H28ClN3O/c1-14(2)21(15-6-8-16(9-7-15)23(3,4)5)25-13-20-26-19-12-17(24)10-11-18(19)22(28)27-20/h6-12,14,21,25H,13H2,1-5H3,(H,26,27,28)/p+1/t21-/m1/s1