4-[2-bromanyl-6-[3-(dimethylamino)prop-1-ynyl]-4-(hydroxymethyl)phenyl]phenol

Systemtic Name: 4-[2-bromanyl-6-[3-(dimethylamino)prop-1-ynyl]-4-(hydroxymethyl)phenyl]phenol Openeye Name: 4-[2-bromo-6-[3-(dimethylamino)prop-1-ynyl]-4-(hydroxymethyl)phenyl]phenol CAS Name: 4-[2-bromo-6-[3-(dimethylamino)prop-1-ynyl]-4-(hydroxymethyl)phenyl]phenol IUPAC Name: 4-[2-bromo-6-[3-(dimethylamino)prop-1-ynyl]-4-(hydroxymethyl)phenyl]phenol Traditional Name: 4-[2-bromo-6-[3-(dimethylamino)prop-1-ynyl]-4-methylol-phenyl]phenol Formula: C18H18BrNO2 MolecularWeight: 360.24502

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC#CC1=CC(=CC(=C1C2=CC=C(C=C2)O)Br)CO

Isomeric SMILES

CN(C)CC#CC1=CC(=CC(=C1C2=CC=C(C=C2)O)Br)CO

InChI

InChI=1S/C18H18BrNO2/c1-20(2)9-3-4-15-10-13(12-21)11-17(19)18(15)14-5-7-16(22)8-6-14/h5-8,10-11,21-22H,9,12H2,1-2H3