methyl 7-[(4,5-dicyano-1H-imidazol-2-yl)carbamoyl]-6-oxidanyl-naphthalene-2-carboxylate

Systemtic Name: methyl 7-[(4,5-dicyano-1H-imidazol-2-yl)carbamoyl]-6-oxidanyl-naphthalene-2-carboxylate Openeye Name: methyl 7-[(4,5-dicyano-1H-imidazol-2-yl)carbamoyl]-6-hydroxy-naphthalene-2-carboxylate CAS Name: 7-[[(4,5-dicyano-1H-imidazol-2-yl)amino]-oxomethyl]-6-hydroxy-2-naphthalenecarboxylic acid methyl ester IUPAC Name: methyl 7-[(4,5-dicyano-1H-imidazol-2-yl)carbamoyl]-6-hydroxynaphthalene-2-carboxylate Traditional Name: 7-[(4,5-dicyano-1H-imidazol-2-yl)carbamoyl]-6-hydroxy-naphthalene-2-carboxylic acid methyl ester Formula: C18H11N5O4 MolecularWeight: 361.31104

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=CC(=C(C=C2C=C1)O)C(=O)NC3=NC(=C(N3)C#N)C#N

Isomeric SMILES

COC(=O)C1=CC2=CC(=C(C=C2C=C1)O)C(=O)NC3=NC(=C(N3)C#N)C#N

InChI

InChI=1S/C18H11N5O4/c1-27-17(26)10-3-2-9-6-15(24)12(5-11(9)4-10)16(25)23-18-21-13(7-19)14(8-20)22-18/h2-6,24H,1H3,(H2,21,22,23,25)