1-[(5-nitro-1H-indol-3-yl)sulfonyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[(5-nitro-1H-indol-3-yl)sulfonyl]piperidine-4-carboxylic acid Openeye Name: 1-[(5-nitro-1H-indol-3-yl)sulfonyl]piperidine-4-carboxylic acid CAS Name: 1-[(5-nitro-1H-indol-3-yl)sulfonyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[(5-nitro-1H-indol-3-yl)sulfonyl]piperidine-4-carboxylic acid Traditional Name: 1-[(5-nitro-1H-indol-3-yl)sulfonyl]isonipecotic acid Formula: C14H15N3O6S MolecularWeight: 353.3504

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)O)S(=O)(=O)C2=CNC3=C2C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1C(=O)O)S(=O)(=O)C2=CNC3=C2C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C14H15N3O6S/c18-14(19)9-3-5-16(6-4-9)24(22,23)13-8-15-12-2-1-10(17(20)21)7-11(12)13/h1-2,7-9,15H,3-6H2,(H,18,19)