7,7-dimethyl-1-propan-2-yl-3-(pyridin-3-ylmethyl)-3,4,6,8-tetrahydro-2H-quinazolin-3-ium-5-one

Systemtic Name: 7,7-dimethyl-1-propan-2-yl-3-(pyridin-3-ylmethyl)-3,4,6,8-tetrahydro-2H-quinazolin-3-ium-5-one Openeye Name: 1-isopropyl-7,7-dimethyl-3-(3-pyridylmethyl)-3,4,6,8-tetrahydro-2H-quinazolin-3-ium-5-one CAS Name: 7,7-dimethyl-1-propan-2-yl-3-(3-pyridinylmethyl)-3,4,6,8-tetrahydro-2H-quinazolin-3-ium-5-one IUPAC Name: 7,7-dimethyl-1-propan-2-yl-3-(pyridin-3-ylmethyl)-3,4,6,8-tetrahydro-2H-quinazolin-3-ium-5-one Traditional Name: 1-isopropyl-7,7-dimethyl-3-(3-pyridylmethyl)-3,4,6,8-tetrahydro-2H-quinazolin-3-ium-5-one Formula: C19H28N3O+ MolecularWeight: 314.44512

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C[NH+](CC2=C1CC(CC2=O)(C)C)CC3=CN=CC=C3

Isomeric SMILES

CC(C)N1C[NH+](CC2=C1CC(CC2=O)(C)C)CC3=CN=CC=C3

InChI

InChI=1S/C19H27N3O/c1-14(2)22-13-21(11-15-6-5-7-20-10-15)12-16-17(22)8-19(3,4)9-18(16)23/h5-7,10,14H,8-9,11-13H2,1-4H3/p+1