4,6-dimethoxy-2-(2-nitro-5-phenylmethoxy-phenyl)indene-1,3-dione

Systemtic Name: 4,6-dimethoxy-2-(2-nitro-5-phenylmethoxy-phenyl)indene-1,3-dione Openeye Name: 2-(5-benzyloxy-2-nitro-phenyl)-4,6-dimethoxy-indane-1,3-dione CAS Name: 4,6-dimethoxy-2-(2-nitro-5-phenylmethoxyphenyl)indene-1,3-dione IUPAC Name: 4,6-dimethoxy-2-(2-nitro-5-phenylmethoxyphenyl)indene-1,3-dione Traditional Name: 2-(5-benzoxy-2-nitro-phenyl)-4,6-dimethoxy-indane-1,3-quinone Formula: C24H19NO7 MolecularWeight: 433.41016

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C2C(=C1)C(=O)C(C2=O)C3=C(C=CC(=C3)OCC4=CC=CC=C4)[N+](=O)[O-])OC

Isomeric SMILES

COC1=CC(=C2C(=C1)C(=O)C(C2=O)C3=C(C=CC(=C3)OCC4=CC=CC=C4)[N+](=O)[O-])OC

InChI

InChI=1S/C24H19NO7/c1-30-16-11-18-21(20(12-16)31-2)24(27)22(23(18)26)17-10-15(8-9-19(17)25(28)29)32-13-14-6-4-3-5-7-14/h3-12,22H,13H2,1-2H3