[3-(2-azanyl-2-oxidanylidene-ethyl)-4-oxidanylidene-quinazolin-2-yl]methyl-cyclooctyl-azanium

Systemtic Name: [3-(2-azanyl-2-oxidanylidene-ethyl)-4-oxidanylidene-quinazolin-2-yl]methyl-cyclooctyl-azanium Openeye Name: [3-(2-amino-2-oxo-ethyl)-4-oxo-quinazolin-2-yl]methyl-cyclooctyl-ammonium CAS Name: [3-(2-amino-2-oxoethyl)-4-oxo-2-quinazolinyl]methyl-cyclooctylammonium IUPAC Name: [3-(2-amino-2-oxoethyl)-4-oxoquinazolin-2-yl]methyl-cyclooctylazanium Traditional Name: [3-(2-amino-2-keto-ethyl)-4-keto-quinazolin-2-yl]methyl-cyclooctyl-ammonium Formula: C19H27N4O2+ MolecularWeight: 343.44328

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CCC1)[NH2+]CC2=NC3=CC=CC=C3C(=O)N2CC(=O)N

Isomeric SMILES

C1CCCC(CCC1)[NH2+]CC2=NC3=CC=CC=C3C(=O)N2CC(=O)N

InChI

InChI=1S/C19H26N4O2/c20-17(24)13-23-18(12-21-14-8-4-2-1-3-5-9-14)22-16-11-7-6-10-15(16)19(23)25/h6-7,10-11,14,21H,1-5,8-9,12-13H2,(H2,20,24)/p+1