4-bromanyl-2-[(4-methylphenyl)-pyrrolidin-1-yl-methyl]phenol

Systemtic Name: 4-bromanyl-2-[(4-methylphenyl)-pyrrolidin-1-yl-methyl]phenol Openeye Name: 4-bromo-2-[p-tolyl(pyrrolidin-1-yl)methyl]phenol CAS Name: 4-bromo-2-[(4-methylphenyl)-(1-pyrrolidinyl)methyl]phenol IUPAC Name: 4-bromo-2-[(4-methylphenyl)-pyrrolidin-1-ylmethyl]phenol Traditional Name: 4-bromo-2-[p-tolyl(pyrrolidino)methyl]phenol Formula: C18H20BrNO MolecularWeight: 346.2615

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C2=C(C=CC(=C2)Br)O)N3CCCC3

Isomeric SMILES

CC1=CC=C(C=C1)C(C2=C(C=CC(=C2)Br)O)N3CCCC3

InChI

InChI=1S/C18H20BrNO/c1-13-4-6-14(7-5-13)18(20-10-2-3-11-20)16-12-15(19)8-9-17(16)21/h4-9,12,18,21H,2-3,10-11H2,1H3