(E)-but-2-enedioic acid; 6-chloranyl-1'-(2-nitrophenyl)spiro[1,2-dihydroindole-3,4'-piperidine]

Systemtic Name: (E)-but-2-enedioic acid; 6-chloranyl-1'-(2-nitrophenyl)spiro[1,2-dihydroindole-3,4'-piperidine] Openeye Name: 6-chloro-1'-(2-nitrophenyl)spiro[indoline-3,4'-piperidine]; fumaric acid CAS Name: (E)-2-butenedioic acid; 6-chloro-1'-(2-nitrophenyl)spiro[1,2-dihydroindole-3,4'-piperidine] IUPAC Name: (E)-but-2-enedioic acid; 6-chloro-1'-(2-nitrophenyl)spiro[1,2-dihydroindole-3,4'-piperidine] Traditional Name: 6-chloro-1'-(2-nitrophenyl)spiro[indoline-3,4'-piperidine]; fumaric acid Formula: C22H22ClN3O6 MolecularWeight: 459.87958

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC12CNC3=C2C=CC(=C3)Cl)C4=CC=CC=C4[N+](=O)[O-].C(=CC(=O)O)C(=O)O

Isomeric SMILES

C1CN(CCC12CNC3=C2C=CC(=C3)Cl)C4=CC=CC=C4[N+](=O)[O-].C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C18H18ClN3O2.C4H4O4/c19-13-5-6-14-15(11-13)20-12-18(14)7-9-21(10-8-18)16-3-1-2-4-17(16)22(23)24;5-3(6)1-2-4(7)8/h1-6,11,20H,7-10,12H2;1-2H,(H,5,6)(H,7,8)/b;2-1+