[2-oxidanylidene-2-[(4-phenylmethoxyphenyl)amino]ethyl] 4-morpholin-4-yl-3-nitro-benzoate

Systemtic Name: [2-oxidanylidene-2-[(4-phenylmethoxyphenyl)amino]ethyl] 4-morpholin-4-yl-3-nitro-benzoate Openeye Name: [2-(4-benzyloxyanilino)-2-oxo-ethyl] 4-morpholino-3-nitro-benzoate CAS Name: 4-(4-morpholinyl)-3-nitrobenzoic acid [2-oxo-2-(4-phenylmethoxyanilino)ethyl] ester IUPAC Name: [2-oxo-2-(4-phenylmethoxyanilino)ethyl] 4-morpholin-4-yl-3-nitrobenzoate Traditional Name: 4-morpholino-3-nitro-benzoic acid [2-(4-benzoxyanilino)-2-keto-ethyl] ester Formula: C26H25N3O7 MolecularWeight: 491.4926

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)C(=O)OCC(=O)NC3=CC=C(C=C3)OCC4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)C(=O)OCC(=O)NC3=CC=C(C=C3)OCC4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C26H25N3O7/c30-25(27-21-7-9-22(10-8-21)35-17-19-4-2-1-3-5-19)18-36-26(31)20-6-11-23(24(16-20)29(32)33)28-12-14-34-15-13-28/h1-11,16H,12-15,17-18H2,(H,27,30)