methyl (6E)-3-cyclohexyl-2-oxidanylidene-1,3-dihydro-1,4-benzodiazonine-5-carboxylate

Systemtic Name: methyl (6E)-3-cyclohexyl-2-oxidanylidene-1,3-dihydro-1,4-benzodiazonine-5-carboxylate Openeye Name: methyl (6E)-3-cyclohexyl-2-oxo-1,3-dihydro-1,4-benzodiazonine-5-carboxylate CAS Name: (6E)-3-cyclohexyl-2-oxo-1,3-dihydro-1,4-benzodiazonine-5-carboxylic acid methyl ester IUPAC Name: methyl (6E)-3-cyclohexyl-2-oxo-1,3-dihydro-1,4-benzodiazonine-5-carboxylate Traditional Name: (6E)-3-cyclohexyl-2-keto-1,3-dihydro-1,4-benzodiazonine-5-carboxylic acid methyl ester Formula: C19H22N2O3 MolecularWeight: 326.38958

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=NC(C(=O)NC2=CC=CC=C2C=C1)C3CCCCC3

Isomeric SMILES

COC(=O)C\1=NC(C(=O)NC2=CC=CC=C2/C=C1)C3CCCCC3

InChI

InChI=1S/C19H22N2O3/c1-24-19(23)16-12-11-13-7-5-6-10-15(13)21-18(22)17(20-16)14-8-3-2-4-9-14/h5-7,10-12,14,17H,2-4,8-9H2,1H3,(H,21,22)/b12-11+,20-16?