ethyl-[(4S)-1-(6-fluoranyl-4-methyl-quinazolin-2-yl)azepan-4-yl]azanium

Systemtic Name: ethyl-[(4S)-1-(6-fluoranyl-4-methyl-quinazolin-2-yl)azepan-4-yl]azanium Openeye Name: ethyl-[(4S)-1-(6-fluoro-4-methyl-quinazolin-2-yl)azepan-4-yl]ammonium CAS Name: ethyl-[(4S)-1-(6-fluoro-4-methyl-2-quinazolinyl)-4-azepanyl]ammonium IUPAC Name: ethyl-[(4S)-1-(6-fluoro-4-methylquinazolin-2-yl)azepan-4-yl]azanium Traditional Name: ethyl-[(4S)-1-(6-fluoro-4-methyl-quinazolin-2-yl)azepan-4-yl]ammonium Formula: C17H24FN4+ MolecularWeight: 303.397663

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH2+]C1CCCN(CC1)C2=NC3=C(C=C(C=C3)F)C(=N2)C

Isomeric SMILES

CC[NH2+][C@H]1CCCN(CC1)C2=NC3=C(C=C(C=C3)F)C(=N2)C

InChI

InChI=1S/C17H23FN4/c1-3-19-14-5-4-9-22(10-8-14)17-20-12(2)15-11-13(18)6-7-16(15)21-17/h6-7,11,14,19H,3-5,8-10H2,1-2H3/p+1/t14-/m0/s1