N-(4-chloranyl-3-nitro-phenyl)-2-(3-pentadecylphenoxy)butanamide

Systemtic Name: N-(4-chloranyl-3-nitro-phenyl)-2-(3-pentadecylphenoxy)butanamide Openeye Name: N-(4-chloro-3-nitro-phenyl)-2-(3-pentadecylphenoxy)butanamide CAS Name: N-(4-chloro-3-nitrophenyl)-2-(3-pentadecylphenoxy)butanamide IUPAC Name: N-(4-chloro-3-nitrophenyl)-2-(3-pentadecylphenoxy)butanamide Traditional Name: N-(4-chloro-3-nitro-phenyl)-2-(3-pentadecylphenoxy)butyramide Formula: C31H45ClN2O4 MolecularWeight: 545.153

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC1=CC(=CC=C1)OC(CC)C(=O)NC2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCCCCC1=CC(=CC=C1)OC(CC)C(=O)NC2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C31H45ClN2O4/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-18-25-19-17-20-27(23-25)38-30(4-2)31(35)33-26-21-22-28(32)29(24-26)34(36)37/h17,19-24,30H,3-16,18H2,1-2H3,(H,33,35)