2-(6-methoxy-2,3-dihydro-1H-inden-5-yl)-3-nitro-benzoic acid

Systemtic Name: 2-(6-methoxy-2,3-dihydro-1H-inden-5-yl)-3-nitro-benzoic acid Openeye Name: 2-(6-methoxyindan-5-yl)-3-nitro-benzoic acid CAS Name: 2-(6-methoxy-2,3-dihydro-1H-inden-5-yl)-3-nitrobenzoic acid IUPAC Name: 2-(6-methoxy-2,3-dihydro-1H-inden-5-yl)-3-nitrobenzoic acid Traditional Name: 2-(6-methoxyindan-5-yl)-3-nitro-benzoic acid Formula: C17H15NO5 MolecularWeight: 313.3047

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(CCC2)C=C1C3=C(C=CC=C3[N+](=O)[O-])C(=O)O

Isomeric SMILES

COC1=CC2=C(CCC2)C=C1C3=C(C=CC=C3[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C17H15NO5/c1-23-15-9-11-5-2-4-10(11)8-13(15)16-12(17(19)20)6-3-7-14(16)18(21)22/h3,6-9H,2,4-5H2,1H3,(H,19,20)