2-[4-[[4-[(3-nitrophenyl)methylamino]phenyl]methylamino]phenyl]ethanoate

Systemtic Name: 2-[4-[[4-[(3-nitrophenyl)methylamino]phenyl]methylamino]phenyl]ethanoate Openeye Name: 2-[4-[[4-[(3-nitrophenyl)methylamino]phenyl]methylamino]phenyl]acetate CAS Name: 2-[4-[[4-[(3-nitrophenyl)methylamino]phenyl]methylamino]phenyl]acetate IUPAC Name: 2-[4-[[4-[(3-nitrophenyl)methylamino]phenyl]methylamino]phenyl]acetate Traditional Name: 2-[4-[[4-[(3-nitrobenzyl)amino]benzyl]amino]phenyl]acetate Formula: C22H20N3O4- MolecularWeight: 390.4119

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])CNC2=CC=C(C=C2)CNC3=CC=C(C=C3)CC(=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])CNC2=CC=C(C=C2)CNC3=CC=C(C=C3)CC(=O)[O-]

InChI

InChI=1S/C22H21N3O4/c26-22(27)13-16-4-8-19(9-5-16)23-14-17-6-10-20(11-7-17)24-15-18-2-1-3-21(12-18)25(28)29/h1-12,23-24H,13-15H2,(H,26,27)/p-1