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

Systemtic Name: dimethyl 5-[2-[(3-fluorophenyl)methyl-methyl-amino]ethanoylamino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[[2-[(3-fluorophenyl)methyl-methyl-amino]acetyl]amino]benzene-1,3-dicarboxylate CAS Name: 5-[[2-[(3-fluorophenyl)methyl-methylamino]-1-oxoethyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[[2-[(3-fluorophenyl)methyl-methylamino]acetyl]amino]benzene-1,3-dicarboxylate Traditional Name: 5-[[2-[(3-fluorobenzyl)-methyl-amino]acetyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C20H21FN2O5 MolecularWeight: 388.389543

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC(=CC=C1)F)CC(=O)NC2=CC(=CC(=C2)C(=O)OC)C(=O)OC

Isomeric SMILES

CN(CC1=CC(=CC=C1)F)CC(=O)NC2=CC(=CC(=C2)C(=O)OC)C(=O)OC

InChI

InChI=1S/C20H21FN2O5/c1-23(11-13-5-4-6-16(21)7-13)12-18(24)22-17-9-14(19(25)27-2)8-15(10-17)20(26)28-3/h4-10H,11-12H2,1-3H3,(H,22,24)