[2-[(4-hydroxyphenyl)amino]-2-oxidanylidene-ethyl] 2-[(2-chlorophenyl)methylamino]-5-nitro-benzoate

Systemtic Name: [2-[(4-hydroxyphenyl)amino]-2-oxidanylidene-ethyl] 2-[(2-chlorophenyl)methylamino]-5-nitro-benzoate Openeye Name: [2-(4-hydroxyanilino)-2-oxo-ethyl] 2-[(2-chlorophenyl)methylamino]-5-nitro-benzoate CAS Name: 2-[(2-chlorophenyl)methylamino]-5-nitrobenzoic acid [2-(4-hydroxyanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-hydroxyanilino)-2-oxoethyl] 2-[(2-chlorophenyl)methylamino]-5-nitrobenzoate Traditional Name: 2-[(2-chlorobenzyl)amino]-5-nitro-benzoic acid [2-(4-hydroxyanilino)-2-keto-ethyl] ester Formula: C22H18ClN3O6 MolecularWeight: 455.84782

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CNC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)OCC(=O)NC3=CC=C(C=C3)O)Cl

Isomeric SMILES

C1=CC=C(C(=C1)CNC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)OCC(=O)NC3=CC=C(C=C3)O)Cl

InChI

InChI=1S/C22H18ClN3O6/c23-19-4-2-1-3-14(19)12-24-20-10-7-16(26(30)31)11-18(20)22(29)32-13-21(28)25-15-5-8-17(27)9-6-15/h1-11,24,27H,12-13H2,(H,25,28)