4-bromanyl-N,N-bis[4-(4-methoxyphenoxy)but-2-ynyl]aniline

Systemtic Name: 4-bromanyl-N,N-bis[4-(4-methoxyphenoxy)but-2-ynyl]aniline Openeye Name: 4-bromo-N,N-bis[4-(4-methoxyphenoxy)but-2-ynyl]aniline CAS Name: 4-bromo-N,N-bis[4-(4-methoxyphenoxy)but-2-ynyl]aniline IUPAC Name: 4-bromo-N,N-bis[4-(4-methoxyphenoxy)but-2-ynyl]aniline Traditional Name: (4-bromophenyl)-bis[4-(4-methoxyphenoxy)but-2-ynyl]amine Formula: C28H26BrNO4 MolecularWeight: 520.41434

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OCC#CCN(CC#CCOC2=CC=C(C=C2)OC)C3=CC=C(C=C3)Br

Isomeric SMILES

COC1=CC=C(C=C1)OCC#CCN(CC#CCOC2=CC=C(C=C2)OC)C3=CC=C(C=C3)Br

InChI

InChI=1S/C28H26BrNO4/c1-31-25-11-15-27(16-12-25)33-21-5-3-19-30(24-9-7-23(29)8-10-24)20-4-6-22-34-28-17-13-26(32-2)14-18-28/h7-18H,19-22H2,1-2H3