[4-iodanyl-3-(4-methoxypiperidin-1-yl)phenyl]-nitro-carbamic acid

Systemtic Name: [4-iodanyl-3-(4-methoxypiperidin-1-yl)phenyl]-nitro-carbamic acid Openeye Name: [4-iodo-3-(4-methoxy-1-piperidyl)phenyl]-nitro-carbamic acid CAS Name: [4-iodo-3-(4-methoxy-1-piperidinyl)phenyl]-nitrocarbamic acid IUPAC Name: [4-iodo-3-(4-methoxypiperidin-1-yl)phenyl]-nitrocarbamic acid Traditional Name: [4-iodo-3-(4-methoxypiperidino)phenyl]-nitro-carbamic acid Formula: C13H16IN3O5 MolecularWeight: 421.18771

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Descriptors Computed from Structure

Canonical SMILES:

COC1CCN(CC1)C2=C(C=CC(=C2)N(C(=O)O)[N+](=O)[O-])I

Isomeric SMILES

COC1CCN(CC1)C2=C(C=CC(=C2)N(C(=O)O)[N+](=O)[O-])I

InChI

InChI=1S/C13H16IN3O5/c1-22-10-4-6-15(7-5-10)12-8-9(2-3-11(12)14)16(13(18)19)17(20)21/h2-3,8,10H,4-7H2,1H3,(H,18,19)