5-chloranyl-N-[[(3S)-1,4-dioxaspiro[4.5]decan-3-yl]methyl]-2-nitro-benzamide

Systemtic Name: 5-chloranyl-N-[[(3S)-1,4-dioxaspiro[4.5]decan-3-yl]methyl]-2-nitro-benzamide Openeye Name: 5-chloro-N-[[(3S)-1,4-dioxaspiro[4.5]decan-3-yl]methyl]-2-nitro-benzamide CAS Name: 5-chloro-N-[[(3S)-1,4-dioxaspiro[4.5]decan-3-yl]methyl]-2-nitrobenzamide IUPAC Name: 5-chloro-N-[[(3S)-1,4-dioxaspiro[4.5]decan-3-yl]methyl]-2-nitrobenzamide Traditional Name: 5-chloro-N-[[(3S)-1,4-dioxaspiro[4.5]decan-3-yl]methyl]-2-nitro-benzamide Formula: C16H19ClN2O5 MolecularWeight: 354.78546

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(CC1)OCC(O2)CNC(=O)C3=C(C=CC(=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1CCC2(CC1)OC[C@@H](O2)CNC(=O)C3=C(C=CC(=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C16H19ClN2O5/c17-11-4-5-14(19(21)22)13(8-11)15(20)18-9-12-10-23-16(24-12)6-2-1-3-7-16/h4-5,8,12H,1-3,6-7,9-10H2,(H,18,20)/t12-/m0/s1