methyl 2-(2-imidazol-1-yl-1-phenyl-ethoxy)-5-oxidanylidene-7,8-dihydro-6H-naphthalene-1-carboxylate

Systemtic Name: methyl 2-(2-imidazol-1-yl-1-phenyl-ethoxy)-5-oxidanylidene-7,8-dihydro-6H-naphthalene-1-carboxylate Openeye Name: methyl 6-(2-imidazol-1-yl-1-phenyl-ethoxy)-1-oxo-tetralin-5-carboxylate CAS Name: 2-[2-(1-imidazolyl)-1-phenylethoxy]-5-oxo-7,8-dihydro-6H-naphthalene-1-carboxylic acid methyl ester IUPAC Name: methyl 2-(2-imidazol-1-yl-1-phenylethoxy)-5-oxo-7,8-dihydro-6H-naphthalene-1-carboxylate Traditional Name: 6-(2-imidazol-1-yl-1-phenyl-ethoxy)-1-keto-tetralin-5-carboxylic acid methyl ester Formula: C23H22N2O4 MolecularWeight: 390.43178

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC2=C1CCCC2=O)OC(CN3C=CN=C3)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=C(C=CC2=C1CCCC2=O)OC(CN3C=CN=C3)C4=CC=CC=C4

InChI

InChI=1S/C23H22N2O4/c1-28-23(27)22-18-8-5-9-19(26)17(18)10-11-20(22)29-21(14-25-13-12-24-15-25)16-6-3-2-4-7-16/h2-4,6-7,10-13,15,21H,5,8-9,14H2,1H3