ethyl 4-[5-[(2-bromanylphenoxy)methyl]furan-2-yl]-2,7,7-trimethyl-5-oxidanylidene-1,4,6,8-tetrahydroquinoline-3-carboxylate

Systemtic Name: ethyl 4-[5-[(2-bromanylphenoxy)methyl]furan-2-yl]-2,7,7-trimethyl-5-oxidanylidene-1,4,6,8-tetrahydroquinoline-3-carboxylate Openeye Name: ethyl 4-[5-[(2-bromophenoxy)methyl]-2-furyl]-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate CAS Name: 4-[5-[(2-bromophenoxy)methyl]-2-furanyl]-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[5-[(2-bromophenoxy)methyl]furan-2-yl]-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate Traditional Name: 4-[5-[(2-bromophenoxy)methyl]-2-furyl]-5-keto-2,7,7-trimethyl-1,4,6,8-tetrahydroquinoline-3-carboxylic acid ethyl ester Formula: C26H28BrNO5 MolecularWeight: 514.40822

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC2=C(C1C3=CC=C(O3)COC4=CC=CC=C4Br)C(=O)CC(C2)(C)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC2=C(C1C3=CC=C(O3)COC4=CC=CC=C4Br)C(=O)CC(C2)(C)C)C

InChI

InChI=1S/C26H28BrNO5/c1-5-31-25(30)22-15(2)28-18-12-26(3,4)13-19(29)23(18)24(22)21-11-10-16(33-21)14-32-20-9-7-6-8-17(20)27/h6-11,24,28H,5,12-14H2,1-4H3