dimethyl 5-[2-[1-adamantyl(methyl)amino]ethanoylamino]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[2-[1-adamantyl(methyl)amino]ethanoylamino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[[2-[1-adamantyl(methyl)amino]acetyl]amino]benzene-1,3-dicarboxylate CAS Name: 5-[[2-[1-adamantyl(methyl)amino]-1-oxoethyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[[2-[1-adamantyl(methyl)amino]acetyl]amino]benzene-1,3-dicarboxylate Traditional Name: 5-[[2-[1-adamantyl(methyl)amino]acetyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C23H30N2O5 MolecularWeight: 414.4947

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NC1=CC(=CC(=C1)C(=O)OC)C(=O)OC)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CN(CC(=O)NC1=CC(=CC(=C1)C(=O)OC)C(=O)OC)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C23H30N2O5/c1-25(23-10-14-4-15(11-23)6-16(5-14)12-23)13-20(26)24-19-8-17(21(27)29-2)7-18(9-19)22(28)30-3/h7-9,14-16H,4-6,10-13H2,1-3H3,(H,24,26)