ethyl 7-[3-(4-bromanyl-2-ethyl-5-phenylmethoxy-phenoxy)propoxy]-8-propyl-3,4-dihydro-2H-chromene-2-carboxylate

Systemtic Name: ethyl 7-[3-(4-bromanyl-2-ethyl-5-phenylmethoxy-phenoxy)propoxy]-8-propyl-3,4-dihydro-2H-chromene-2-carboxylate Openeye Name: ethyl 7-[3-(5-benzyloxy-4-bromo-2-ethyl-phenoxy)propoxy]-8-propyl-chromane-2-carboxylate CAS Name: 7-[3-(4-bromo-2-ethyl-5-phenylmethoxyphenoxy)propoxy]-8-propyl-3,4-dihydro-2H-1-benzopyran-2-carboxylic acid ethyl ester IUPAC Name: ethyl 7-[3-(4-bromo-2-ethyl-5-phenylmethoxyphenoxy)propoxy]-8-propyl-3,4-dihydro-2H-chromene-2-carboxylate Traditional Name: 7-[3-(5-benzoxy-4-bromo-2-ethyl-phenoxy)propoxy]-8-propyl-chroman-2-carboxylic acid ethyl ester Formula: C33H39BrO6 MolecularWeight: 611.56316

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC2=C1OC(CC2)C(=O)OCC)OCCCOC3=CC(=C(C=C3CC)Br)OCC4=CC=CC=C4

Isomeric SMILES

CCCC1=C(C=CC2=C1OC(CC2)C(=O)OCC)OCCCOC3=CC(=C(C=C3CC)Br)OCC4=CC=CC=C4

InChI

InChI=1S/C33H39BrO6/c1-4-11-26-28(16-14-25-15-17-29(40-32(25)26)33(35)36-6-3)37-18-10-19-38-30-21-31(27(34)20-24(30)5-2)39-22-23-12-8-7-9-13-23/h7-9,12-14,16,20-21,29H,4-6,10-11,15,17-19,22H2,1-3H3