[2-(4-methyl-3-nitro-phenyl)-2-oxidanylidene-ethyl] 2-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanoate

Systemtic Name: [2-(4-methyl-3-nitro-phenyl)-2-oxidanylidene-ethyl] 2-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanoate Openeye Name: [2-(4-methyl-3-nitro-phenyl)-2-oxo-ethyl] 2-tetralin-6-ylacetate CAS Name: 2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetic acid [2-(4-methyl-3-nitrophenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-methyl-3-nitrophenyl)-2-oxoethyl] 2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetate Traditional Name: 2-tetralin-6-ylacetic acid [2-keto-2-(4-methyl-3-nitro-phenyl)ethyl] ester Formula: C21H21NO5 MolecularWeight: 367.39514

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)COC(=O)CC2=CC3=C(CCCC3)C=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)COC(=O)CC2=CC3=C(CCCC3)C=C2)[N+](=O)[O-]

InChI

InChI=1S/C21H21NO5/c1-14-6-8-18(12-19(14)22(25)26)20(23)13-27-21(24)11-15-7-9-16-4-2-3-5-17(16)10-15/h6-10,12H,2-5,11,13H2,1H3