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

Systemtic Name: 4-[[[2-cyclohexyl-1,3-bis(oxidanylidene)isoindol-5-yl]carbonylamino]methyl]benzoate Openeye Name: 4-[[(2-cyclohexyl-1,3-dioxo-isoindoline-5-carbonyl)amino]methyl]benzoate CAS Name: 4-[[[(2-cyclohexyl-1,3-dioxo-5-isoindolyl)-oxomethyl]amino]methyl]benzoate IUPAC Name: 4-[[(2-cyclohexyl-1,3-dioxoisoindole-5-carbonyl)amino]methyl]benzoate Traditional Name: 4-[[(2-cyclohexyl-1,3-diketo-isoindoline-5-carbonyl)amino]methyl]benzoate Formula: C23H21N2O5- MolecularWeight: 405.42324

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)NCC4=CC=C(C=C4)C(=O)[O-]

Isomeric SMILES

C1CCC(CC1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)NCC4=CC=C(C=C4)C(=O)[O-]

InChI

InChI=1S/C23H22N2O5/c26-20(24-13-14-6-8-15(9-7-14)23(29)30)16-10-11-18-19(12-16)22(28)25(21(18)27)17-4-2-1-3-5-17/h6-12,17H,1-5,13H2,(H,24,26)(H,29,30)/p-1