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

Systemtic Name: [1,3-bis(oxidanylidene)isoindol-2-yl]methyl 2-(cyclohexylcarbonylamino)-4,5-dimethoxy-benzoate Openeye Name: (1,3-dioxoisoindolin-2-yl)methyl 2-(cyclohexanecarbonylamino)-4,5-dimethoxy-benzoate CAS Name: 2-[[cyclohexyl(oxo)methyl]amino]-4,5-dimethoxybenzoic acid (1,3-dioxo-2-isoindolyl)methyl ester IUPAC Name: (1,3-dioxoisoindol-2-yl)methyl 2-(cyclohexanecarbonylamino)-4,5-dimethoxybenzoate Traditional Name: 2-(cyclohexanecarbonylamino)-4,5-dimethoxy-benzoic acid phthalimidomethyl ester Formula: C25H26N2O7 MolecularWeight: 466.48314

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)OCN2C(=O)C3=CC=CC=C3C2=O)NC(=O)C4CCCCC4)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)OCN2C(=O)C3=CC=CC=C3C2=O)NC(=O)C4CCCCC4)OC

InChI

InChI=1S/C25H26N2O7/c1-32-20-12-18(19(13-21(20)33-2)26-22(28)15-8-4-3-5-9-15)25(31)34-14-27-23(29)16-10-6-7-11-17(16)24(27)30/h6-7,10-13,15H,3-5,8-9,14H2,1-2H3,(H,26,28)