ethenylbenzene; 2-methylbuta-1,3-diene; octane

Systemtic Name: ethenylbenzene; 2-methylbuta-1,3-diene; octane Openeye Name: isoprene; octane; styrene CAS Name: 2-methylbuta-1,3-diene; octane; styrene IUPAC Name: 2-methylbuta-1,3-diene; octane; styrene Traditional Name: isoprene; n-octane; styrene Formula: C29H42 MolecularWeight: 390.64378

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC.CC(=C)C=C.C=CC1=CC=CC=C1.C=CC1=CC=CC=C1

Isomeric SMILES

CCCCCCCC.CC(=C)C=C.C=CC1=CC=CC=C1.C=CC1=CC=CC=C1

InChI

InChI=1S/2C8H8.C8H18.C5H8/c2*1-2-8-6-4-3-5-7-8;1-3-5-7-8-6-4-2;1-4-5(2)3/h2*2-7H,1H2;3-8H2,1-2H3;4H,1-2H2,3H3