(E,2S,3R)-3-[(2-bromophenyl)methyl-(3-phenylprop-2-ynyl)amino]-1-phenyl-non-4-en-2-ol

Systemtic Name: (E,2S,3R)-3-[(2-bromophenyl)methyl-(3-phenylprop-2-ynyl)amino]-1-phenyl-non-4-en-2-ol Openeye Name: (E,2S,3R)-3-[(2-bromophenyl)methyl-(3-phenylprop-2-ynyl)amino]-1-phenyl-non-4-en-2-ol CAS Name: (E,2S,3R)-3-[(2-bromophenyl)methyl-(3-phenylprop-2-ynyl)amino]-1-phenyl-4-nonen-2-ol IUPAC Name: (E,2S,3R)-3-[(2-bromophenyl)methyl-(3-phenylprop-2-ynyl)amino]-1-phenylnon-4-en-2-ol Traditional Name: (E,2S,3R)-3-[(2-bromobenzyl)-(3-phenylprop-2-ynyl)amino]-1-phenyl-non-4-en-2-ol Formula: C31H34BrNO MolecularWeight: 516.51176

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC=CC(C(CC1=CC=CC=C1)O)N(CC#CC2=CC=CC=C2)CC3=CC=CC=C3Br

Isomeric SMILES

CCCC/C=C/[C@H]([C@H](CC1=CC=CC=C1)O)N(CC#CC2=CC=CC=C2)CC3=CC=CC=C3Br

InChI

InChI=1S/C31H34BrNO/c1-2-3-4-11-22-30(31(34)24-27-17-9-6-10-18-27)33(25-28-20-12-13-21-29(28)32)23-14-19-26-15-7-5-8-16-26/h5-13,15-18,20-22,30-31,34H,2-4,23-25H2,1H3/b22-11+/t30-,31+/m1/s1