oxan-4-yl-[(5S)-2-pyridin-3-yl-5,6,7,8-tetrahydroquinazolin-5-yl]azanium

Systemtic Name: oxan-4-yl-[(5S)-2-pyridin-3-yl-5,6,7,8-tetrahydroquinazolin-5-yl]azanium Openeye Name: [(5S)-2-(3-pyridyl)-5,6,7,8-tetrahydroquinazolin-5-yl]-tetrahydropyran-4-yl-ammonium CAS Name: 4-oxanyl-[(5S)-2-(3-pyridinyl)-5,6,7,8-tetrahydroquinazolin-5-yl]ammonium IUPAC Name: oxan-4-yl-[(5S)-2-pyridin-3-yl-5,6,7,8-tetrahydroquinazolin-5-yl]azanium Traditional Name: [(5S)-2-(3-pyridyl)-5,6,7,8-tetrahydroquinazolin-5-yl]-tetrahydropyran-4-yl-ammonium Formula: C18H23N4O+ MolecularWeight: 311.40142

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C2=CN=C(N=C2C1)C3=CN=CC=C3)[NH2+]C4CCOCC4

Isomeric SMILES

C1C[C@@H](C2=CN=C(N=C2C1)C3=CN=CC=C3)[NH2+]C4CCOCC4

InChI

InChI=1S/C18H22N4O/c1-4-16(21-14-6-9-23-10-7-14)15-12-20-18(22-17(15)5-1)13-3-2-8-19-11-13/h2-3,8,11-12,14,16,21H,1,4-7,9-10H2/p+1/t16-/m0/s1