benzene; 1-bromanylbutane; 3-prop-2-enoxyprop-1-ene

Systemtic Name: benzene; 1-bromanylbutane; 3-prop-2-enoxyprop-1-ene Openeye Name: 3-allyloxyprop-1-ene; benzene; 1-bromobutane CAS Name: benzene; 1-bromobutane; 3-prop-2-enoxy-1-propene IUPAC Name: benzene; 1-bromobutane; 3-prop-2-enoxyprop-1-ene Traditional Name: 3-allyloxyprop-1-ene; benzene; 1-bromobutane Formula: C16H25BrO MolecularWeight: 313.2731

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Descriptors Computed from Structure

Canonical SMILES:

CCCCBr.C=CCOCC=C.C1=CC=CC=C1

Isomeric SMILES

CCCCBr.C=CCOCC=C.C1=CC=CC=C1

InChI

InChI=1S/C6H10O.C6H6.C4H9Br/c1-3-5-7-6-4-2;1-2-4-6-5-3-1;1-2-3-4-5/h3-4H,1-2,5-6H2;1-6H;2-4H2,1H3