(4-aminocarbonyl-2-nitro-phenyl)methyl 2-(cyclopentylcarbonylamino)-4,5-dimethoxy-benzoate

Systemtic Name: (4-aminocarbonyl-2-nitro-phenyl)methyl 2-(cyclopentylcarbonylamino)-4,5-dimethoxy-benzoate Openeye Name: (4-carbamoyl-2-nitro-phenyl)methyl 2-(cyclopentanecarbonylamino)-4,5-dimethoxy-benzoate CAS Name: 2-[[cyclopentyl(oxo)methyl]amino]-4,5-dimethoxybenzoic acid (4-carbamoyl-2-nitrophenyl)methyl ester IUPAC Name: (4-carbamoyl-2-nitrophenyl)methyl 2-(cyclopentanecarbonylamino)-4,5-dimethoxybenzoate Traditional Name: 2-(cyclopentanecarbonylamino)-4,5-dimethoxy-benzoic acid (4-carbamoyl-2-nitro-benzyl) ester Formula: C23H25N3O8 MolecularWeight: 471.4599

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)OCC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-])NC(=O)C3CCCC3)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)OCC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-])NC(=O)C3CCCC3)OC

InChI

InChI=1S/C23H25N3O8/c1-32-19-10-16(17(11-20(19)33-2)25-22(28)13-5-3-4-6-13)23(29)34-12-15-8-7-14(21(24)27)9-18(15)26(30)31/h7-11,13H,3-6,12H2,1-2H3,(H2,24,27)(H,25,28)