1-(3-methoxyphenyl)-8-(4-nitrophenyl)octane-2,7-dione

Systemtic Name: 1-(3-methoxyphenyl)-8-(4-nitrophenyl)octane-2,7-dione Openeye Name: 1-(3-methoxyphenyl)-8-(4-nitrophenyl)octane-2,7-dione CAS Name: 1-(3-methoxyphenyl)-8-(4-nitrophenyl)octane-2,7-dione IUPAC Name: 1-(3-methoxyphenyl)-8-(4-nitrophenyl)octane-2,7-dione Traditional Name: 1-(3-methoxyphenyl)-8-(4-nitrophenyl)octane-2,7-dione Formula: C21H23NO5 MolecularWeight: 369.41102

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CC(=O)CCCCC(=O)CC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC(=C1)CC(=O)CCCCC(=O)CC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C21H23NO5/c1-27-21-8-4-5-17(15-21)14-20(24)7-3-2-6-19(23)13-16-9-11-18(12-10-16)22(25)26/h4-5,8-12,15H,2-3,6-7,13-14H2,1H3