1-[(4-nitro-1H-pyrrol-2-yl)carbonylamino]cycloheptane-1-carboxylic acid

Systemtic Name: 1-[(4-nitro-1H-pyrrol-2-yl)carbonylamino]cycloheptane-1-carboxylic acid Openeye Name: 1-[(4-nitro-1H-pyrrole-2-carbonyl)amino]cycloheptanecarboxylic acid CAS Name: 1-[[(4-nitro-1H-pyrrol-2-yl)-oxomethyl]amino]-1-cycloheptanecarboxylic acid IUPAC Name: 1-[(4-nitro-1H-pyrrole-2-carbonyl)amino]cycloheptane-1-carboxylic acid Traditional Name: 1-[(4-nitro-1H-pyrrole-2-carbonyl)amino]cycloheptanecarboxylic acid Formula: C13H17N3O5 MolecularWeight: 295.29118

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)(C(=O)O)NC(=O)C2=CC(=CN2)[N+](=O)[O-]

Isomeric SMILES

C1CCCC(CC1)(C(=O)O)NC(=O)C2=CC(=CN2)[N+](=O)[O-]

InChI

InChI=1S/C13H17N3O5/c17-11(10-7-9(8-14-10)16(20)21)15-13(12(18)19)5-3-1-2-4-6-13/h7-8,14H,1-6H2,(H,15,17)(H,18,19)