2-methylpropylbenzene; 1-[4-(2-methylpropyl)phenyl]ethanone

Systemtic Name: 2-methylpropylbenzene; 1-[4-(2-methylpropyl)phenyl]ethanone Openeye Name: isobutylbenzene; 1-(4-isobutylphenyl)ethanone CAS Name: 2-methylpropylbenzene; 1-[4-(2-methylpropyl)phenyl]ethanone IUPAC Name: 2-methylpropylbenzene; 1-[4-(2-methylpropyl)phenyl]ethanone Traditional Name: isobutylbenzene; 1-(4-isobutylphenyl)ethanone Formula: C22H30O MolecularWeight: 310.473

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H16O.C10H14/c1-9(2)8-11-4-6-12(7-5-11)10(3)13;1-9(2)8-10-6-4-3-5-7-10/h4-7,9H,8H2,1-3H3;3-7,9H,8H2,1-2H3