5-(azepan-1-yl)-1,3,6-trimethyl-pyrido[2,3-d]pyrimidin-8-ium-2,4-dione

Systemtic Name: 5-(azepan-1-yl)-1,3,6-trimethyl-pyrido[2,3-d]pyrimidin-8-ium-2,4-dione Openeye Name: 5-(azepan-1-yl)-1,3,6-trimethyl-pyrido[2,3-d]pyrimidin-8-ium-2,4-dione CAS Name: 5-(1-azepanyl)-1,3,6-trimethylpyrido[2,3-d]pyrimidin-8-ium-2,4-dione IUPAC Name: 5-(azepan-1-yl)-1,3,6-trimethylpyrido[2,3-d]pyrimidin-8-ium-2,4-dione Traditional Name: 5-(azepan-1-yl)-1,3,6-trimethyl-pyrido[2,3-d]pyrimidin-8-ium-2,4-quinone Formula: C16H23N4O2+ MolecularWeight: 303.37942

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C[NH+]=C2C(=C1N3CCCCCC3)C(=O)N(C(=O)N2C)C

Isomeric SMILES

CC1=C[NH+]=C2C(=C1N3CCCCCC3)C(=O)N(C(=O)N2C)C

InChI

InChI=1S/C16H22N4O2/c1-11-10-17-14-12(15(21)19(3)16(22)18(14)2)13(11)20-8-6-4-5-7-9-20/h10H,4-9H2,1-3H3/p+1