dimethyl 2-[2-[(3-acetamido-1-adamantyl)carbonyloxy]ethanoylamino]benzene-1,4-dicarboxylate

Systemtic Name: dimethyl 2-[2-[(3-acetamido-1-adamantyl)carbonyloxy]ethanoylamino]benzene-1,4-dicarboxylate Openeye Name: dimethyl 2-[[2-(3-acetamidoadamantane-1-carbonyl)oxyacetyl]amino]benzene-1,4-dicarboxylate CAS Name: 2-[[2-[(3-acetamido-1-adamantyl)-oxomethoxy]-1-oxoethyl]amino]benzene-1,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-[[2-(3-acetamidoadamantane-1-carbonyl)oxyacetyl]amino]benzene-1,4-dicarboxylate Traditional Name: 2-[[2-(3-acetamidoadamantane-1-carbonyl)oxyacetyl]amino]benzene-1,4-dicarboxylic acid dimethyl ester Formula: C25H30N2O8 MolecularWeight: 486.5143

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC12CC3CC(C1)CC(C3)(C2)C(=O)OCC(=O)NC4=C(C=CC(=C4)C(=O)OC)C(=O)OC

Isomeric SMILES

CC(=O)NC12CC3CC(C1)CC(C3)(C2)C(=O)OCC(=O)NC4=C(C=CC(=C4)C(=O)OC)C(=O)OC

InChI

InChI=1S/C25H30N2O8/c1-14(28)27-25-10-15-6-16(11-25)9-24(8-15,13-25)23(32)35-12-20(29)26-19-7-17(21(30)33-2)4-5-18(19)22(31)34-3/h4-5,7,15-16H,6,8-13H2,1-3H3,(H,26,29)(H,27,28)