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

Systemtic Name: dimethyl 5-[2-[methyl-[(2-nitrophenyl)methyl]amino]ethanoylamino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[[2-[methyl-[(2-nitrophenyl)methyl]amino]acetyl]amino]benzene-1,3-dicarboxylate CAS Name: 5-[[2-[methyl-[(2-nitrophenyl)methyl]amino]-1-oxoethyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[[2-[methyl-[(2-nitrophenyl)methyl]amino]acetyl]amino]benzene-1,3-dicarboxylate Traditional Name: 5-[[2-[methyl-(2-nitrobenzyl)amino]acetyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C20H21N3O7 MolecularWeight: 415.39664

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1[N+](=O)[O-])CC(=O)NC2=CC(=CC(=C2)C(=O)OC)C(=O)OC

Isomeric SMILES

CN(CC1=CC=CC=C1[N+](=O)[O-])CC(=O)NC2=CC(=CC(=C2)C(=O)OC)C(=O)OC

InChI

InChI=1S/C20H21N3O7/c1-22(11-13-6-4-5-7-17(13)23(27)28)12-18(24)21-16-9-14(19(25)29-2)8-15(10-16)20(26)30-3/h4-10H,11-12H2,1-3H3,(H,21,24)