(2-methyl-3-oxidanylidene-1,2-dihydroinden-4-yl) 4-nitrobenzoate

Systemtic Name: (2-methyl-3-oxidanylidene-1,2-dihydroinden-4-yl) 4-nitrobenzoate Openeye Name: (2-methyl-3-oxo-indan-4-yl) 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid (2-methyl-3-oxo-1,2-dihydroinden-4-yl) ester IUPAC Name: (2-methyl-3-oxo-1,2-dihydroinden-4-yl) 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid (3-keto-2-methyl-indan-4-yl) ester Formula: C17H13NO5 MolecularWeight: 311.28882

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=C(C1=O)C(=CC=C2)OC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1CC2=C(C1=O)C(=CC=C2)OC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H13NO5/c1-10-9-12-3-2-4-14(15(12)16(10)19)23-17(20)11-5-7-13(8-6-11)18(21)22/h2-8,10H,9H2,1H3