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

Systemtic Name: methyl 3-[[2-cyclohexyl-1,3-bis(oxidanylidene)isoindol-5-yl]carbonylamino]-3-phenyl-propanoate Openeye Name: methyl 3-[(2-cyclohexyl-1,3-dioxo-isoindoline-5-carbonyl)amino]-3-phenyl-propanoate CAS Name: 3-[[(2-cyclohexyl-1,3-dioxo-5-isoindolyl)-oxomethyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl 3-[(2-cyclohexyl-1,3-dioxoisoindole-5-carbonyl)amino]-3-phenylpropanoate Traditional Name: 3-[(2-cyclohexyl-1,3-diketo-isoindoline-5-carbonyl)amino]-3-phenyl-propionic acid methyl ester Formula: C25H26N2O5 MolecularWeight: 434.48434

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(C1=CC=CC=C1)NC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)C4CCCCC4

Isomeric SMILES

COC(=O)CC(C1=CC=CC=C1)NC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)C4CCCCC4

InChI

InChI=1S/C25H26N2O5/c1-32-22(28)15-21(16-8-4-2-5-9-16)26-23(29)17-12-13-19-20(14-17)25(31)27(24(19)30)18-10-6-3-7-11-18/h2,4-5,8-9,12-14,18,21H,3,6-7,10-11,15H2,1H3,(H,26,29)