N'-(2-chloranyl-4-nitro-phenyl)-N-[(3-methoxy-4-phenethyloxy-phenyl)methyl]ethane-1,2-diamine

Systemtic Name: N'-(2-chloranyl-4-nitro-phenyl)-N-[(3-methoxy-4-phenethyloxy-phenyl)methyl]ethane-1,2-diamine Openeye Name: N'-(2-chloro-4-nitro-phenyl)-N-[(3-methoxy-4-phenethyloxy-phenyl)methyl]ethane-1,2-diamine CAS Name: N'-(2-chloro-4-nitrophenyl)-N-[(3-methoxy-4-phenethyloxyphenyl)methyl]ethane-1,2-diamine IUPAC Name: N'-(2-chloro-4-nitrophenyl)-N-[(3-methoxy-4-phenethyloxyphenyl)methyl]ethane-1,2-diamine Traditional Name: 2-(2-chloro-4-nitro-anilino)ethyl-(3-methoxy-4-phenethyloxy-benzyl)amine Formula: C24H26ClN3O4 MolecularWeight: 455.93394

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CNCCNC2=C(C=C(C=C2)[N+](=O)[O-])Cl)OCCC3=CC=CC=C3

Isomeric SMILES

COC1=C(C=CC(=C1)CNCCNC2=C(C=C(C=C2)[N+](=O)[O-])Cl)OCCC3=CC=CC=C3

InChI

InChI=1S/C24H26ClN3O4/c1-31-24-15-19(7-10-23(24)32-14-11-18-5-3-2-4-6-18)17-26-12-13-27-22-9-8-20(28(29)30)16-21(22)25/h2-10,15-16,26-27H,11-14,17H2,1H3