(2E)-2-[(1-methyl-5-nitro-imidazol-2-yl)methylidene]-6-(2-pyrrolidin-1-ylethoxy)-3,4-dihydronaphthalen-1-one

Systemtic Name: (2E)-2-[(1-methyl-5-nitro-imidazol-2-yl)methylidene]-6-(2-pyrrolidin-1-ylethoxy)-3,4-dihydronaphthalen-1-one Openeye Name: (2E)-2-[(1-methyl-5-nitro-imidazol-2-yl)methylene]-6-(2-pyrrolidin-1-ylethoxy)tetralin-1-one CAS Name: (2E)-2-[(1-methyl-5-nitro-2-imidazolyl)methylidene]-6-[2-(1-pyrrolidinyl)ethoxy]-3,4-dihydronaphthalen-1-one IUPAC Name: (2E)-2-[(1-methyl-5-nitroimidazol-2-yl)methylidene]-6-(2-pyrrolidin-1-ylethoxy)-3,4-dihydronaphthalen-1-one Traditional Name: (2E)-2-[(1-methyl-5-nitro-imidazol-2-yl)methylene]-6-(2-pyrrolidinoethoxy)tetralin-1-one Formula: C21H24N4O4 MolecularWeight: 396.43966

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CN=C1C=C2CCC3=C(C2=O)C=CC(=C3)OCCN4CCCC4)[N+](=O)[O-]

Isomeric SMILES

CN1C(=CN=C1/C=C/2\CCC3=C(C2=O)C=CC(=C3)OCCN4CCCC4)[N+](=O)[O-]

InChI

InChI=1S/C21H24N4O4/c1-23-19(22-14-20(23)25(27)28)13-16-5-4-15-12-17(6-7-18(15)21(16)26)29-11-10-24-8-2-3-9-24/h6-7,12-14H,2-5,8-11H2,1H3/b16-13+