2-[[(5-tert-butyl-1,3-oxazol-2-yl)methyl-ethyl-azaniumyl]methyl]-7-chloranyl-quinazolin-4-olate

Systemtic Name: 2-[[(5-tert-butyl-1,3-oxazol-2-yl)methyl-ethyl-azaniumyl]methyl]-7-chloranyl-quinazolin-4-olate Openeye Name: 2-[[(5-tert-butyloxazol-2-yl)methyl-ethyl-ammonio]methyl]-7-chloro-quinazolin-4-olate CAS Name: 2-[[(5-tert-butyl-2-oxazolyl)methyl-ethylammonio]methyl]-7-chloro-4-quinazolinolate IUPAC Name: 2-[[(5-tert-butyl-1,3-oxazol-2-yl)methyl-ethylazaniumyl]methyl]-7-chloroquinazolin-4-olate Traditional Name: 2-[[(5-tert-butyloxazol-2-yl)methyl-ethyl-ammonio]methyl]-7-chloro-quinazolin-4-olate Formula: C19H23ClN4O2 MolecularWeight: 374.86452

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=NC2=C(C=CC(=C2)Cl)C(=N1)[O-])CC3=NC=C(O3)C(C)(C)C

Isomeric SMILES

CC[NH+](CC1=NC2=C(C=CC(=C2)Cl)C(=N1)[O-])CC3=NC=C(O3)C(C)(C)C

InChI

InChI=1S/C19H23ClN4O2/c1-5-24(11-17-21-9-15(26-17)19(2,3)4)10-16-22-14-8-12(20)6-7-13(14)18(25)23-16/h6-9H,5,10-11H2,1-4H3,(H,22,23,25)