[2-(2,3-dihydro-1H-inden-5-yl)-2-oxidanylidene-ethyl] 3-nitrobenzoate

Systemtic Name: [2-(2,3-dihydro-1H-inden-5-yl)-2-oxidanylidene-ethyl] 3-nitrobenzoate Openeye Name: (2-indan-5-yl-2-oxo-ethyl) 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid [2-(2,3-dihydro-1H-inden-5-yl)-2-oxoethyl] ester IUPAC Name: [2-(2,3-dihydro-1H-inden-5-yl)-2-oxoethyl] 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid (2-indan-5-yl-2-keto-ethyl) ester Formula: C18H15NO5 MolecularWeight: 325.3154

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C=C(C=C2)C(=O)COC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1CC2=C(C1)C=C(C=C2)C(=O)COC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H15NO5/c20-17(14-8-7-12-3-1-4-13(12)9-14)11-24-18(21)15-5-2-6-16(10-15)19(22)23/h2,5-10H,1,3-4,11H2