N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-propyl]-2-(4-nitroimidazol-1-yl)ethanamide

Systemtic Name: N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-propyl]-2-(4-nitroimidazol-1-yl)ethanamide Openeye Name: N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-propyl]-2-(4-nitroimidazol-1-yl)acetamide CAS Name: N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methylpropyl]-2-(4-nitro-1-imidazolyl)acetamide IUPAC Name: N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methylpropyl]-2-(4-nitroimidazol-1-yl)acetamide Traditional Name: N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-propyl]-2-(4-nitroimidazol-1-yl)acetamide Formula: C18H22N4O5 MolecularWeight: 374.39108

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=CC2=C(C=C1)OCCCO2)NC(=O)CN3C=C(N=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)C(C1=CC2=C(C=C1)OCCCO2)NC(=O)CN3C=C(N=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H22N4O5/c1-12(2)18(13-4-5-14-15(8-13)27-7-3-6-26-14)20-17(23)10-21-9-16(19-11-21)22(24)25/h4-5,8-9,11-12,18H,3,6-7,10H2,1-2H3,(H,20,23)