dimethyl 5-[2-[ethyl-(3-methylphenyl)amino]ethylcarbamoylamino]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[2-[ethyl-(3-methylphenyl)amino]ethylcarbamoylamino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[2-(N-ethyl-3-methyl-anilino)ethylcarbamoylamino]benzene-1,3-dicarboxylate CAS Name: 5-[[[2-(N-ethyl-3-methylanilino)ethylamino]-oxomethyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[2-(N-ethyl-3-methylanilino)ethylcarbamoylamino]benzene-1,3-dicarboxylate Traditional Name: 5-[2-(N-ethyl-3-methyl-anilino)ethylcarbamoylamino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C22H27N3O5 MolecularWeight: 413.46688

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCNC(=O)NC1=CC(=CC(=C1)C(=O)OC)C(=O)OC)C2=CC=CC(=C2)C

Isomeric SMILES

CCN(CCNC(=O)NC1=CC(=CC(=C1)C(=O)OC)C(=O)OC)C2=CC=CC(=C2)C

InChI

InChI=1S/C22H27N3O5/c1-5-25(19-8-6-7-15(2)11-19)10-9-23-22(28)24-18-13-16(20(26)29-3)12-17(14-18)21(27)30-4/h6-8,11-14H,5,9-10H2,1-4H3,(H2,23,24,28)