(7-acetamido-2-oxidanylidene-chromen-4-yl)methyl 2-(2,3-dihydroindol-1-ylcarbonyl)cyclohexane-1-carboxylate

Systemtic Name: (7-acetamido-2-oxidanylidene-chromen-4-yl)methyl 2-(2,3-dihydroindol-1-ylcarbonyl)cyclohexane-1-carboxylate Openeye Name: (7-acetamido-2-oxo-chromen-4-yl)methyl 2-(indoline-1-carbonyl)cyclohexanecarboxylate CAS Name: 2-[2,3-dihydroindol-1-yl(oxo)methyl]-1-cyclohexanecarboxylic acid (7-acetamido-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-acetamido-2-oxochromen-4-yl)methyl 2-(2,3-dihydroindole-1-carbonyl)cyclohexane-1-carboxylate Traditional Name: 2-(indoline-1-carbonyl)cyclohexanecarboxylic acid (7-acetamido-2-keto-chromen-4-yl)methyl ester Formula: C28H28N2O6 MolecularWeight: 488.53172

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)C3CCCCC3C(=O)N4CCC5=CC=CC=C54

Isomeric SMILES

CC(=O)NC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)C3CCCCC3C(=O)N4CCC5=CC=CC=C54

InChI

InChI=1S/C28H28N2O6/c1-17(31)29-20-10-11-21-19(14-26(32)36-25(21)15-20)16-35-28(34)23-8-4-3-7-22(23)27(33)30-13-12-18-6-2-5-9-24(18)30/h2,5-6,9-11,14-15,22-23H,3-4,7-8,12-13,16H2,1H3,(H,29,31)