6-ethyl-1,3-dimethyl-5-(pyridin-3-ylmethylamino)pyrido[2,3-d]pyrimidin-8-ium-2,4-dione

Systemtic Name: 6-ethyl-1,3-dimethyl-5-(pyridin-3-ylmethylamino)pyrido[2,3-d]pyrimidin-8-ium-2,4-dione Openeye Name: 6-ethyl-1,3-dimethyl-5-(3-pyridylmethylamino)pyrido[2,3-d]pyrimidin-8-ium-2,4-dione CAS Name: 6-ethyl-1,3-dimethyl-5-(3-pyridinylmethylamino)pyrido[2,3-d]pyrimidin-8-ium-2,4-dione IUPAC Name: 6-ethyl-1,3-dimethyl-5-(pyridin-3-ylmethylamino)pyrido[2,3-d]pyrimidin-8-ium-2,4-dione Traditional Name: 6-ethyl-1,3-dimethyl-5-(3-pyridylmethylamino)pyrido[2,3-d]pyrimidin-8-ium-2,4-quinone Formula: C17H20N5O2+ MolecularWeight: 326.373

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C[NH+]=C2C(=C1NCC3=CN=CC=C3)C(=O)N(C(=O)N2C)C

Isomeric SMILES

CCC1=C[NH+]=C2C(=C1NCC3=CN=CC=C3)C(=O)N(C(=O)N2C)C

InChI

InChI=1S/C17H19N5O2/c1-4-12-10-20-15-13(16(23)22(3)17(24)21(15)2)14(12)19-9-11-6-5-7-18-8-11/h5-8,10H,4,9H2,1-3H3,(H,19,20)/p+1