N-[2-[4-[(2,4-dichlorophenyl)methylamino]phenyl]ethyl]-3-nitro-aniline

Systemtic Name: N-[2-[4-[(2,4-dichlorophenyl)methylamino]phenyl]ethyl]-3-nitro-aniline Openeye Name: N-[2-[4-[(2,4-dichlorophenyl)methylamino]phenyl]ethyl]-3-nitro-aniline CAS Name: N-[2-[4-[(2,4-dichlorophenyl)methylamino]phenyl]ethyl]-3-nitroaniline IUPAC Name: N-[2-[4-[(2,4-dichlorophenyl)methylamino]phenyl]ethyl]-3-nitroaniline Traditional Name: (2,4-dichlorobenzyl)-[4-[2-(3-nitroanilino)ethyl]phenyl]amine Formula: C21H19Cl2N3O2 MolecularWeight: 416.30046

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])NCCC2=CC=C(C=C2)NCC3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])NCCC2=CC=C(C=C2)NCC3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C21H19Cl2N3O2/c22-17-7-6-16(21(23)12-17)14-25-18-8-4-15(5-9-18)10-11-24-19-2-1-3-20(13-19)26(27)28/h1-9,12-13,24-25H,10-11,14H2