methyl 4-[[2-[4-(4-bromanylphenoxy)-2,5-dimethyl-thiophen-3-yl]ethylamino]methyl]benzoate

Systemtic Name: methyl 4-[[2-[4-(4-bromanylphenoxy)-2,5-dimethyl-thiophen-3-yl]ethylamino]methyl]benzoate Openeye Name: methyl 4-[[2-[4-(4-bromophenoxy)-2,5-dimethyl-3-thienyl]ethylamino]methyl]benzoate CAS Name: 4-[[2-[4-(4-bromophenoxy)-2,5-dimethyl-3-thiophenyl]ethylamino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-[4-(4-bromophenoxy)-2,5-dimethylthiophen-3-yl]ethylamino]methyl]benzoate Traditional Name: 4-[[2-[4-(4-bromophenoxy)-2,5-dimethyl-3-thienyl]ethylamino]methyl]benzoic acid methyl ester Formula: C23H24BrNO3S MolecularWeight: 474.41056

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(S1)C)OC2=CC=C(C=C2)Br)CCNCC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CC1=C(C(=C(S1)C)OC2=CC=C(C=C2)Br)CCNCC3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C23H24BrNO3S/c1-15-21(22(16(2)29-15)28-20-10-8-19(24)9-11-20)12-13-25-14-17-4-6-18(7-5-17)23(26)27-3/h4-11,25H,12-14H2,1-3H3