dimethyl 5-[(4-ethanoyl-1,4-diazepan-1-yl)carbonylamino]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[(4-ethanoyl-1,4-diazepan-1-yl)carbonylamino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[(4-acetyl-1,4-diazepane-1-carbonyl)amino]benzene-1,3-dicarboxylate CAS Name: 5-[[(4-acetyl-1,4-diazepan-1-yl)-oxomethyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[(4-acetyl-1,4-diazepane-1-carbonyl)amino]benzene-1,3-dicarboxylate Traditional Name: 5-[(4-acetyl-1,4-diazepane-1-carbonyl)amino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C18H23N3O6 MolecularWeight: 377.39172

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCCN(CC1)C(=O)NC2=CC(=CC(=C2)C(=O)OC)C(=O)OC

Isomeric SMILES

CC(=O)N1CCCN(CC1)C(=O)NC2=CC(=CC(=C2)C(=O)OC)C(=O)OC

InChI

InChI=1S/C18H23N3O6/c1-12(22)20-5-4-6-21(8-7-20)18(25)19-15-10-13(16(23)26-2)9-14(11-15)17(24)27-3/h9-11H,4-8H2,1-3H3,(H,19,25)