2-[4-(2-azanylethoxy)-3-nitro-phenyl]-N-[4-(3,4-dimethylphenyl)butyl]ethanamide

Systemtic Name: 2-[4-(2-azanylethoxy)-3-nitro-phenyl]-N-[4-(3,4-dimethylphenyl)butyl]ethanamide Openeye Name: 2-[4-(2-aminoethoxy)-3-nitro-phenyl]-N-[4-(3,4-dimethylphenyl)butyl]acetamide CAS Name: 2-[4-(2-aminoethoxy)-3-nitrophenyl]-N-[4-(3,4-dimethylphenyl)butyl]acetamide IUPAC Name: 2-[4-(2-aminoethoxy)-3-nitrophenyl]-N-[4-(3,4-dimethylphenyl)butyl]acetamide Traditional Name: 2-[4-(2-aminoethoxy)-3-nitro-phenyl]-N-[4-(3,4-dimethylphenyl)butyl]acetamide Formula: C22H29N3O4 MolecularWeight: 399.48336

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CCCCNC(=O)CC2=CC(=C(C=C2)OCCN)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C=C(C=C1)CCCCNC(=O)CC2=CC(=C(C=C2)OCCN)[N+](=O)[O-])C

InChI

InChI=1S/C22H29N3O4/c1-16-6-7-18(13-17(16)2)5-3-4-11-24-22(26)15-19-8-9-21(29-12-10-23)20(14-19)25(27)28/h6-9,13-14H,3-5,10-12,15,23H2,1-2H3,(H,24,26)