(6-bromanyl-1-prop-2-enyl-naphthalen-2-yl) 4-methylbenzenesulfonate

Systemtic Name: (6-bromanyl-1-prop-2-enyl-naphthalen-2-yl) 4-methylbenzenesulfonate Openeye Name: (1-allyl-6-bromo-2-naphthyl) 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (6-bromo-1-prop-2-enyl-2-naphthalenyl) ester IUPAC Name: (6-bromo-1-prop-2-enylnaphthalen-2-yl) 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (1-allyl-6-bromo-2-naphthyl) ester Formula: C20H17BrO3S MolecularWeight: 417.31618

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C3=C(C=C2)C=C(C=C3)Br)CC=C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C3=C(C=C2)C=C(C=C3)Br)CC=C

InChI

InChI=1S/C20H17BrO3S/c1-3-4-19-18-11-8-16(21)13-15(18)7-12-20(19)24-25(22,23)17-9-5-14(2)6-10-17/h3,5-13H,1,4H2,2H3