(4-azanylidene-3-cyano-2-oxidanylidene-pentyl) 1,4-bis(oxidanyl)naphthalene-2-carboxylate

Systemtic Name: (4-azanylidene-3-cyano-2-oxidanylidene-pentyl) 1,4-bis(oxidanyl)naphthalene-2-carboxylate Openeye Name: (3-cyano-4-imino-2-oxo-pentyl) 1,4-dihydroxynaphthalene-2-carboxylate CAS Name: 1,4-dihydroxy-2-naphthalenecarboxylic acid (3-cyano-4-imino-2-oxopentyl) ester IUPAC Name: (3-cyano-4-imino-2-oxopentyl) 1,4-dihydroxynaphthalene-2-carboxylate Traditional Name: 1,4-dihydroxynaphthalene-2-carboxylic acid (3-cyano-4-imino-2-keto-pentyl) ester Formula: C17H14N2O5 MolecularWeight: 326.30346

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Descriptors Computed from Structure

Canonical SMILES:

CC(=N)C(C#N)C(=O)COC(=O)C1=C(C2=CC=CC=C2C(=C1)O)O

Isomeric SMILES

CC(=N)C(C#N)C(=O)COC(=O)C1=C(C2=CC=CC=C2C(=C1)O)O

InChI

InChI=1S/C17H14N2O5/c1-9(19)13(7-18)15(21)8-24-17(23)12-6-14(20)10-4-2-3-5-11(10)16(12)22/h2-6,13,19-20,22H,8H2,1H3