7-nitro-6-oxidanyl-5-phenylmethoxy-2,3-dihydroinden-1-one

Systemtic Name: 7-nitro-6-oxidanyl-5-phenylmethoxy-2,3-dihydroinden-1-one Openeye Name: 5-benzyloxy-6-hydroxy-7-nitro-indan-1-one CAS Name: 6-hydroxy-7-nitro-5-phenylmethoxy-2,3-dihydroinden-1-one IUPAC Name: 6-hydroxy-7-nitro-5-phenylmethoxy-2,3-dihydroinden-1-one Traditional Name: 5-benzoxy-6-hydroxy-7-nitro-indan-1-one Formula: C16H13NO5 MolecularWeight: 299.27812

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)C2=C(C(=C(C=C21)OCC3=CC=CC=C3)O)[N+](=O)[O-]

Isomeric SMILES

C1CC(=O)C2=C(C(=C(C=C21)OCC3=CC=CC=C3)O)[N+](=O)[O-]

InChI

InChI=1S/C16H13NO5/c18-12-7-6-11-8-13(16(19)15(14(11)12)17(20)21)22-9-10-4-2-1-3-5-10/h1-5,8,19H,6-7,9H2