hexyl-[(1R)-1-(3-methyl-4-oxidanylidene-quinazolin-2-yl)ethyl]azanium

Systemtic Name: hexyl-[(1R)-1-(3-methyl-4-oxidanylidene-quinazolin-2-yl)ethyl]azanium Openeye Name: hexyl-[(1R)-1-(3-methyl-4-oxo-quinazolin-2-yl)ethyl]ammonium CAS Name: hexyl-[(1R)-1-(3-methyl-4-oxo-2-quinazolinyl)ethyl]ammonium IUPAC Name: hexyl-[(1R)-1-(3-methyl-4-oxoquinazolin-2-yl)ethyl]azanium Traditional Name: hexyl-[(1R)-1-(4-keto-3-methyl-quinazolin-2-yl)ethyl]ammonium Formula: C17H26N3O+ MolecularWeight: 288.40784

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC[NH2+]C(C)C1=NC2=CC=CC=C2C(=O)N1C

Isomeric SMILES

CCCCCC[NH2+][C@H](C)C1=NC2=CC=CC=C2C(=O)N1C

InChI

InChI=1S/C17H25N3O/c1-4-5-6-9-12-18-13(2)16-19-15-11-8-7-10-14(15)17(21)20(16)3/h7-8,10-11,13,18H,4-6,9,12H2,1-3H3/p+1/t13-/m1/s1