2-nitro-5-(2-oxidanylidenespiro[1H-indole-3,1'-cyclohexane]-5-yl)pyrrole-1-carboxylic acid

Systemtic Name: 2-nitro-5-(2-oxidanylidenespiro[1H-indole-3,1'-cyclohexane]-5-yl)pyrrole-1-carboxylic acid Openeye Name: 2-nitro-5-(2'-oxospiro[cyclohexane-1,3'-indoline]-5'-yl)pyrrole-1-carboxylic acid CAS Name: 2-nitro-5-(2-oxo-5-spiro[1H-indole-3,1'-cyclohexane]yl)-1-pyrrolecarboxylic acid IUPAC Name: 2-nitro-5-(2-oxospiro[1H-indole-3,1'-cyclohexane]-5-yl)pyrrole-1-carboxylic acid Traditional Name: 2-(2'-ketospiro[cyclohexane-1,3'-indoline]-5'-yl)-5-nitro-pyrrole-1-carboxylic acid Formula: C18H17N3O5 MolecularWeight: 355.34468

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(CC1)C3=C(C=CC(=C3)C4=CC=C(N4C(=O)O)[N+](=O)[O-])NC2=O

Isomeric SMILES

C1CCC2(CC1)C3=C(C=CC(=C3)C4=CC=C(N4C(=O)O)[N+](=O)[O-])NC2=O

InChI

InChI=1S/C18H17N3O5/c22-16-18(8-2-1-3-9-18)12-10-11(4-5-13(12)19-16)14-6-7-15(21(25)26)20(14)17(23)24/h4-7,10H,1-3,8-9H2,(H,19,22)(H,23,24)