2-methyl-9-(nitrooxymethyl)-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine-3-carboxylic acid

Systemtic Name: 2-methyl-9-(nitrooxymethyl)-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine-3-carboxylic acid Openeye Name: 2-methyl-9-(nitrooxymethyl)-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine-3-carboxylic acid CAS Name: 2-methyl-9-(nitrooxymethyl)-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine-3-carboxylic acid IUPAC Name: 2-methyl-9-(nitrooxymethyl)-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine-3-carboxylic acid Traditional Name: 2-methyl-9-(nitrooxymethyl)-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine-3-carboxylic acid Formula: C13H16N2O5 MolecularWeight: 280.27654

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(CCCCC2CO[N+](=O)[O-])C=C1C(=O)O

Isomeric SMILES

CC1=NC2=C(CCCCC2CO[N+](=O)[O-])C=C1C(=O)O

InChI

InChI=1S/C13H16N2O5/c1-8-11(13(16)17)6-9-4-2-3-5-10(12(9)14-8)7-20-15(18)19/h6,10H,2-5,7H2,1H3,(H,16,17)