1-(4-nitrophenyl)-6a-pyrrolidin-1-yl-3a,4,5,6-tetrahydrocyclopenta[c]pyrazole-3-carboxylic acid

Systemtic Name: 1-(4-nitrophenyl)-6a-pyrrolidin-1-yl-3a,4,5,6-tetrahydrocyclopenta[c]pyrazole-3-carboxylic acid Openeye Name: 1-(4-nitrophenyl)-6a-pyrrolidin-1-yl-3a,4,5,6-tetrahydrocyclopenta[c]pyrazole-3-carboxylic acid CAS Name: 1-(4-nitrophenyl)-6a-(1-pyrrolidinyl)-3a,4,5,6-tetrahydrocyclopenta[c]pyrazole-3-carboxylic acid IUPAC Name: 1-(4-nitrophenyl)-6a-pyrrolidin-1-yl-3a,4,5,6-tetrahydrocyclopenta[c]pyrazole-3-carboxylic acid Traditional Name: 1-(4-nitrophenyl)-6a-pyrrolidino-3a,4,5,6-tetrahydrocyclopenta[c]pyrazole-3-carboxylic acid Formula: C17H20N4O4 MolecularWeight: 344.3651

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C23CCCC2C(=NN3C4=CC=C(C=C4)[N+](=O)[O-])C(=O)O

Isomeric SMILES

C1CCN(C1)C23CCCC2C(=NN3C4=CC=C(C=C4)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C17H20N4O4/c22-16(23)15-14-4-3-9-17(14,19-10-1-2-11-19)20(18-15)12-5-7-13(8-6-12)21(24)25/h5-8,14H,1-4,9-11H2,(H,22,23)