1-(2,3-dihydro-1H-inden-5-yloxymethyl)-4-nitro-pyrazole-3-carboxylic acid

Systemtic Name: 1-(2,3-dihydro-1H-inden-5-yloxymethyl)-4-nitro-pyrazole-3-carboxylic acid Openeye Name: 1-(indan-5-yloxymethyl)-4-nitro-pyrazole-3-carboxylic acid CAS Name: 1-(2,3-dihydro-1H-inden-5-yloxymethyl)-4-nitro-3-pyrazolecarboxylic acid IUPAC Name: 1-(2,3-dihydro-1H-inden-5-yloxymethyl)-4-nitropyrazole-3-carboxylic acid Traditional Name: 1-(indan-5-yloxymethyl)-4-nitro-pyrazole-3-carboxylic acid Formula: C14H13N3O5 MolecularWeight: 303.27012

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C=C(C=C2)OCN3C=C(C(=N3)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1CC2=C(C1)C=C(C=C2)OCN3C=C(C(=N3)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C14H13N3O5/c18-14(19)13-12(17(20)21)7-16(15-13)8-22-11-5-4-9-2-1-3-10(9)6-11/h4-7H,1-3,8H2,(H,18,19)