2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl 2-(cyclohexylcarbonylamino)-4,5-dimethoxy-benzoate

Systemtic Name: 2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl 2-(cyclohexylcarbonylamino)-4,5-dimethoxy-benzoate Openeye Name: 2-(1,3-dioxoisoindolin-2-yl)ethyl 2-(cyclohexanecarbonylamino)-4,5-dimethoxy-benzoate CAS Name: 2-[[cyclohexyl(oxo)methyl]amino]-4,5-dimethoxybenzoic acid 2-(1,3-dioxo-2-isoindolyl)ethyl ester IUPAC Name: 2-(1,3-dioxoisoindol-2-yl)ethyl 2-(cyclohexanecarbonylamino)-4,5-dimethoxybenzoate Traditional Name: 2-(cyclohexanecarbonylamino)-4,5-dimethoxy-benzoic acid 2-phthalimidoethyl ester Formula: C26H28N2O7 MolecularWeight: 480.50972

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)OCCN2C(=O)C3=CC=CC=C3C2=O)NC(=O)C4CCCCC4)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)OCCN2C(=O)C3=CC=CC=C3C2=O)NC(=O)C4CCCCC4)OC

InChI

InChI=1S/C26H28N2O7/c1-33-21-14-19(20(15-22(21)34-2)27-23(29)16-8-4-3-5-9-16)26(32)35-13-12-28-24(30)17-10-6-7-11-18(17)25(28)31/h6-7,10-11,14-16H,3-5,8-9,12-13H2,1-2H3,(H,27,29)