3-bromanyl-N-[(E)-but-2-enyl]-N-[2-[4-(4-methylphenyl)phenoxy]ethyl]aniline

Systemtic Name: 3-bromanyl-N-[(E)-but-2-enyl]-N-[2-[4-(4-methylphenyl)phenoxy]ethyl]aniline Openeye Name: 3-bromo-N-[(E)-but-2-enyl]-N-[2-[4-(p-tolyl)phenoxy]ethyl]aniline CAS Name: 3-bromo-N-[(E)-but-2-enyl]-N-[2-[4-(4-methylphenyl)phenoxy]ethyl]aniline IUPAC Name: 3-bromo-N-[(E)-but-2-enyl]-N-[2-[4-(4-methylphenyl)phenoxy]ethyl]aniline Traditional Name: (3-bromophenyl)-[(E)-but-2-enyl]-[2-[4-(p-tolyl)phenoxy]ethyl]amine Formula: C25H26BrNO MolecularWeight: 436.38404

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Descriptors Computed from Structure

Canonical SMILES:

CC=CCN(CCOC1=CC=C(C=C1)C2=CC=C(C=C2)C)C3=CC(=CC=C3)Br

Isomeric SMILES

C/C=C/CN(CCOC1=CC=C(C=C1)C2=CC=C(C=C2)C)C3=CC(=CC=C3)Br

InChI

InChI=1S/C25H26BrNO/c1-3-4-16-27(24-7-5-6-23(26)19-24)17-18-28-25-14-12-22(13-15-25)21-10-8-20(2)9-11-21/h3-15,19H,16-18H2,1-2H3/b4-3+