2-[4-(2-azanylethoxy)-3-nitro-phenyl]-N-[3-(1,3-benzodioxol-5-yl)propyl]ethanamide

Systemtic Name: 2-[4-(2-azanylethoxy)-3-nitro-phenyl]-N-[3-(1,3-benzodioxol-5-yl)propyl]ethanamide Openeye Name: 2-[4-(2-aminoethoxy)-3-nitro-phenyl]-N-[3-(1,3-benzodioxol-5-yl)propyl]acetamide CAS Name: 2-[4-(2-aminoethoxy)-3-nitrophenyl]-N-[3-(1,3-benzodioxol-5-yl)propyl]acetamide IUPAC Name: 2-[4-(2-aminoethoxy)-3-nitrophenyl]-N-[3-(1,3-benzodioxol-5-yl)propyl]acetamide Traditional Name: 2-[4-(2-aminoethoxy)-3-nitro-phenyl]-N-[3-(1,3-benzodioxol-5-yl)propyl]acetamide Formula: C20H23N3O6 MolecularWeight: 401.41312

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CCCNC(=O)CC3=CC(=C(C=C3)OCCN)[N+](=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CCCNC(=O)CC3=CC(=C(C=C3)OCCN)[N+](=O)[O-]

InChI

InChI=1S/C20H23N3O6/c21-7-9-27-17-5-4-15(10-16(17)23(25)26)12-20(24)22-8-1-2-14-3-6-18-19(11-14)29-13-28-18/h3-6,10-11H,1-2,7-9,12-13,21H2,(H,22,24)