(8Z)-8-(3-ethoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-1,3-dimethyl-9H-purin-3-ium-2,6-dione

Systemtic Name: (8Z)-8-(3-ethoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-1,3-dimethyl-9H-purin-3-ium-2,6-dione Openeye Name: (8Z)-8-(3-ethoxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)-1,3-dimethyl-9H-purin-3-ium-2,6-dione CAS Name: (8Z)-8-(3-ethoxy-4-oxo-1-cyclohexa-2,5-dienylidene)-1,3-dimethyl-9H-purin-3-ium-2,6-dione IUPAC Name: (8Z)-8-(3-ethoxy-4-oxocyclohexa-2,5-dien-1-ylidene)-1,3-dimethyl-9H-purin-3-ium-2,6-dione Traditional Name: (8Z)-8-(3-ethoxy-4-keto-cyclohexa-2,5-dien-1-ylidene)-1,3-dimethyl-9H-purin-3-ium-2,6-quinone Formula: C15H15N4O4+ MolecularWeight: 315.304

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C2NC3=[N+](C(=O)N(C(=O)C3=N2)C)C)C=CC1=O

Isomeric SMILES

CCOC1=C/C(=C\2/NC3=[N+](C(=O)N(C(=O)C3=N2)C)C)/C=CC1=O

InChI

InChI=1S/C15H14N4O4/c1-4-23-10-7-8(5-6-9(10)20)12-16-11-13(17-12)18(2)15(22)19(3)14(11)21/h5-7H,4H2,1-3H3/p+1/b12-8+