N-[3-(4-chloranyl-3-methyl-phenoxy)-5-nitro-phenyl]-3-[(4-ethylphenoxy)methyl]benzamide

Systemtic Name: N-[3-(4-chloranyl-3-methyl-phenoxy)-5-nitro-phenyl]-3-[(4-ethylphenoxy)methyl]benzamide Openeye Name: N-[3-(4-chloro-3-methyl-phenoxy)-5-nitro-phenyl]-3-[(4-ethylphenoxy)methyl]benzamide CAS Name: N-[3-(4-chloro-3-methylphenoxy)-5-nitrophenyl]-3-[(4-ethylphenoxy)methyl]benzamide IUPAC Name: N-[3-(4-chloro-3-methylphenoxy)-5-nitrophenyl]-3-[(4-ethylphenoxy)methyl]benzamide Traditional Name: N-[3-(4-chloro-3-methyl-phenoxy)-5-nitro-phenyl]-3-[(4-ethylphenoxy)methyl]benzamide Formula: C29H25ClN2O5 MolecularWeight: 516.9722

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)OCC2=CC=CC(=C2)C(=O)NC3=CC(=CC(=C3)OC4=CC(=C(C=C4)Cl)C)[N+](=O)[O-]

Isomeric SMILES

CCC1=CC=C(C=C1)OCC2=CC=CC(=C2)C(=O)NC3=CC(=CC(=C3)OC4=CC(=C(C=C4)Cl)C)[N+](=O)[O-]

InChI

InChI=1S/C29H25ClN2O5/c1-3-20-7-9-25(10-8-20)36-18-21-5-4-6-22(14-21)29(33)31-23-15-24(32(34)35)17-27(16-23)37-26-11-12-28(30)19(2)13-26/h4-17H,3,18H2,1-2H3,(H,31,33)