methyl 1-[[1,3-bis(oxidanylidene)-2-prop-2-enyl-isoindol-5-yl]carbonylamino]cyclohexane-1-carboxylate

Systemtic Name: methyl 1-[[1,3-bis(oxidanylidene)-2-prop-2-enyl-isoindol-5-yl]carbonylamino]cyclohexane-1-carboxylate Openeye Name: methyl 1-[(2-allyl-1,3-dioxo-isoindoline-5-carbonyl)amino]cyclohexanecarboxylate CAS Name: 1-[[(1,3-dioxo-2-prop-2-enyl-5-isoindolyl)-oxomethyl]amino]-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 1-[(1,3-dioxo-2-prop-2-enylisoindole-5-carbonyl)amino]cyclohexane-1-carboxylate Traditional Name: 1-[(2-allyl-1,3-diketo-isoindoline-5-carbonyl)amino]cyclohexanecarboxylic acid methyl ester Formula: C20H22N2O5 MolecularWeight: 370.39908

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1(CCCCC1)NC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)CC=C

Isomeric SMILES

COC(=O)C1(CCCCC1)NC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)CC=C

InChI

InChI=1S/C20H22N2O5/c1-3-11-22-17(24)14-8-7-13(12-15(14)18(22)25)16(23)21-20(19(26)27-2)9-5-4-6-10-20/h3,7-8,12H,1,4-6,9-11H2,2H3,(H,21,23)