methyl 2-[2-[[4-(dimethylamino)-3-nitro-phenyl]carbonyl-methyl-amino]ethanoylamino]benzoate

Systemtic Name: methyl 2-[2-[[4-(dimethylamino)-3-nitro-phenyl]carbonyl-methyl-amino]ethanoylamino]benzoate Openeye Name: methyl 2-[[2-[[4-(dimethylamino)-3-nitro-benzoyl]-methyl-amino]acetyl]amino]benzoate CAS Name: 2-[[2-[[[4-(dimethylamino)-3-nitrophenyl]-oxomethyl]-methylamino]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[2-[[4-(dimethylamino)-3-nitrobenzoyl]-methylamino]acetyl]amino]benzoate Traditional Name: 2-[[2-[[4-(dimethylamino)-3-nitro-benzoyl]-methyl-amino]acetyl]amino]benzoic acid methyl ester Formula: C20H22N4O6 MolecularWeight: 414.41188

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C=C(C=C1)C(=O)N(C)CC(=O)NC2=CC=CC=C2C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CN(C)C1=C(C=C(C=C1)C(=O)N(C)CC(=O)NC2=CC=CC=C2C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C20H22N4O6/c1-22(2)16-10-9-13(11-17(16)24(28)29)19(26)23(3)12-18(25)21-15-8-6-5-7-14(15)20(27)30-4/h5-11H,12H2,1-4H3,(H,21,25)