[2-(2-bromanyl-5-methyl-phenyl)-8-methoxy-3-oxidanylidene-4-azaspiro[4.5]dec-1-en-1-yl] 2-methylpropanoate

Systemtic Name: [2-(2-bromanyl-5-methyl-phenyl)-8-methoxy-3-oxidanylidene-4-azaspiro[4.5]dec-1-en-1-yl] 2-methylpropanoate Openeye Name: [2-(2-bromo-5-methyl-phenyl)-8-methoxy-3-oxo-4-azaspiro[4.5]dec-1-en-1-yl] 2-methylpropanoate CAS Name: 2-methylpropanoic acid [2-(2-bromo-5-methylphenyl)-8-methoxy-3-oxo-4-azaspiro[4.5]dec-1-en-1-yl] ester IUPAC Name: [2-(2-bromo-5-methylphenyl)-8-methoxy-3-oxo-4-azaspiro[4.5]dec-1-en-1-yl] 2-methylpropanoate Traditional Name: 2-methylpropionic acid [2-(2-bromo-5-methyl-phenyl)-3-keto-8-methoxy-4-azaspiro[4.5]dec-1-en-1-yl] ester Formula: C21H26BrNO4 MolecularWeight: 436.33944

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)Br)C2=C(C3(CCC(CC3)OC)NC2=O)OC(=O)C(C)C

Isomeric SMILES

CC1=CC(=C(C=C1)Br)C2=C(C3(CCC(CC3)OC)NC2=O)OC(=O)C(C)C

InChI

InChI=1S/C21H26BrNO4/c1-12(2)20(25)27-18-17(15-11-13(3)5-6-16(15)22)19(24)23-21(18)9-7-14(26-4)8-10-21/h5-6,11-12,14H,7-10H2,1-4H3,(H,23,24)