N-(1,4-dioxaspiro[4.5]decan-3-ylmethyl)-N'-(4-methyl-2-nitro-phenyl)ethanediamide

Systemtic Name: N-(1,4-dioxaspiro[4.5]decan-3-ylmethyl)-N'-(4-methyl-2-nitro-phenyl)ethanediamide Openeye Name: N-(1,4-dioxaspiro[4.5]decan-3-ylmethyl)-N'-(4-methyl-2-nitro-phenyl)oxamide CAS Name: N-(1,4-dioxaspiro[4.5]decan-3-ylmethyl)-N'-(4-methyl-2-nitrophenyl)oxamide IUPAC Name: N-(1,4-dioxaspiro[4.5]decan-3-ylmethyl)-N'-(4-methyl-2-nitrophenyl)oxamide Traditional Name: N-(1,4-dioxaspiro[4.5]decan-3-ylmethyl)-N'-(4-methyl-2-nitro-phenyl)oxamide Formula: C18H23N3O6 MolecularWeight: 377.39172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C(=O)NCC2COC3(O2)CCCCC3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C(=O)NCC2COC3(O2)CCCCC3)[N+](=O)[O-]

InChI

InChI=1S/C18H23N3O6/c1-12-5-6-14(15(9-12)21(24)25)20-17(23)16(22)19-10-13-11-26-18(27-13)7-3-2-4-8-18/h5-6,9,13H,2-4,7-8,10-11H2,1H3,(H,19,22)(H,20,23)