(5,5-dimethyl-3-oxidanylidene-cyclohexen-1-yl) 2-(6-bromanyl-2-methoxy-naphthalen-1-yl)ethanoate

Systemtic Name: (5,5-dimethyl-3-oxidanylidene-cyclohexen-1-yl) 2-(6-bromanyl-2-methoxy-naphthalen-1-yl)ethanoate Openeye Name: (5,5-dimethyl-3-oxo-cyclohexen-1-yl) 2-(6-bromo-2-methoxy-1-naphthyl)acetate CAS Name: 2-(6-bromo-2-methoxy-1-naphthalenyl)acetic acid (5,5-dimethyl-3-oxo-1-cyclohexenyl) ester IUPAC Name: (5,5-dimethyl-3-oxocyclohexen-1-yl) 2-(6-bromo-2-methoxynaphthalen-1-yl)acetate Traditional Name: 2-(6-bromo-2-methoxy-1-naphthyl)acetic acid (3-keto-5,5-dimethyl-cyclohexen-1-yl) ester Formula: C21H21BrO4 MolecularWeight: 417.29304

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=CC(=O)C1)OC(=O)CC2=C(C=CC3=C2C=CC(=C3)Br)OC)C

Isomeric SMILES

CC1(CC(=CC(=O)C1)OC(=O)CC2=C(C=CC3=C2C=CC(=C3)Br)OC)C

InChI

InChI=1S/C21H21BrO4/c1-21(2)11-15(23)9-16(12-21)26-20(24)10-18-17-6-5-14(22)8-13(17)4-7-19(18)25-3/h4-9H,10-12H2,1-3H3