4-(3-chlorophenyl)-1,7-diethyl-4aH-pyrido[2,3-d]pyrimidin-1-ium-2-one

Systemtic Name: 4-(3-chlorophenyl)-1,7-diethyl-4aH-pyrido[2,3-d]pyrimidin-1-ium-2-one Openeye Name: 4-(3-chlorophenyl)-1,7-diethyl-4aH-pyrido[2,3-d]pyrimidin-1-ium-2-one CAS Name: 4-(3-chlorophenyl)-1,7-diethyl-4aH-pyrido[2,3-d]pyrimidin-1-ium-2-one IUPAC Name: 4-(3-chlorophenyl)-1,7-diethyl-4aH-pyrido[2,3-d]pyrimidin-1-ium-2-one Traditional Name: 4-(3-chlorophenyl)-1,7-diethyl-4aH-pyrido[2,3-d]pyrimidin-1-ium-2-one Formula: C17H17ClN3O+ MolecularWeight: 314.78938

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=[N+](C(=O)N=C(C2C=C1)C3=CC(=CC=C3)Cl)CC

Isomeric SMILES

CCC1=NC2=[N+](C(=O)N=C(C2C=C1)C3=CC(=CC=C3)Cl)CC

InChI

InChI=1S/C17H17ClN3O/c1-3-13-8-9-14-15(11-6-5-7-12(18)10-11)20-17(22)21(4-2)16(14)19-13/h5-10,14H,3-4H2,1-2H3/q+1