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

Systemtic Name: dimethyl 2-[2-[(3-chloranyl-1-adamantyl)carbonyloxy]ethanoylamino]benzene-1,4-dicarboxylate Openeye Name: dimethyl 2-[[2-(3-chloroadamantane-1-carbonyl)oxyacetyl]amino]benzene-1,4-dicarboxylate CAS Name: 2-[[2-[(3-chloro-1-adamantyl)-oxomethoxy]-1-oxoethyl]amino]benzene-1,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-[[2-(3-chloroadamantane-1-carbonyl)oxyacetyl]amino]benzene-1,4-dicarboxylate Traditional Name: 2-[[2-(3-chloroadamantane-1-carbonyl)oxyacetyl]amino]benzene-1,4-dicarboxylic acid dimethyl ester Formula: C23H26ClNO7 MolecularWeight: 463.90804

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)C(=O)OC)NC(=O)COC(=O)C23CC4CC(C2)CC(C4)(C3)Cl

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)C(=O)OC)NC(=O)COC(=O)C23CC4CC(C2)CC(C4)(C3)Cl

InChI

InChI=1S/C23H26ClNO7/c1-30-19(27)15-3-4-16(20(28)31-2)17(6-15)25-18(26)11-32-21(29)22-7-13-5-14(8-22)10-23(24,9-13)12-22/h3-4,6,13-14H,5,7-12H2,1-2H3,(H,25,26)