1,4-dioxa-8-azaspiro[4.5]decan-8-yl-(4-imidazol-1-yl-3-nitro-phenyl)methanone

Systemtic Name: 1,4-dioxa-8-azaspiro[4.5]decan-8-yl-(4-imidazol-1-yl-3-nitro-phenyl)methanone Openeye Name: 1,4-dioxa-8-azaspiro[4.5]decan-8-yl-(4-imidazol-1-yl-3-nitro-phenyl)methanone CAS Name: 1,4-dioxa-8-azaspiro[4.5]decan-8-yl-[4-(1-imidazolyl)-3-nitrophenyl]methanone IUPAC Name: 1,4-dioxa-8-azaspiro[4.5]decan-8-yl-(4-imidazol-1-yl-3-nitrophenyl)methanone Traditional Name: 1,4-dioxa-8-azaspiro[4.5]decan-8-yl-(4-imidazol-1-yl-3-nitro-phenyl)methanone Formula: C17H18N4O5 MolecularWeight: 358.34862

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC12OCCO2)C(=O)C3=CC(=C(C=C3)N4C=CN=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC12OCCO2)C(=O)C3=CC(=C(C=C3)N4C=CN=C4)[N+](=O)[O-]

InChI

InChI=1S/C17H18N4O5/c22-16(19-6-3-17(4-7-19)25-9-10-26-17)13-1-2-14(15(11-13)21(23)24)20-8-5-18-12-20/h1-2,5,8,11-12H,3-4,6-7,9-10H2