4-tert-butyl-1-(chloromethyl)-2-propan-2-yl-benzene; 1-tert-butyl-3-propan-2-yl-benzene

Systemtic Name: 4-tert-butyl-1-(chloromethyl)-2-propan-2-yl-benzene; 1-tert-butyl-3-propan-2-yl-benzene Openeye Name: 4-tert-butyl-1-(chloromethyl)-2-isopropyl-benzene; 1-tert-butyl-3-isopropyl-benzene CAS Name: 4-tert-butyl-1-(chloromethyl)-2-propan-2-ylbenzene; 1-tert-butyl-3-propan-2-ylbenzene IUPAC Name: 4-tert-butyl-1-(chloromethyl)-2-propan-2-ylbenzene; 1-tert-butyl-3-propan-2-ylbenzene Traditional Name: 4-tert-butyl-1-(chloromethyl)-2-isopropyl-benzene; 1-tert-butyl-3-isopropyl-benzene Formula: C27H41Cl MolecularWeight: 401.06744

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=CC=C1)C(C)(C)C.CC(C)C1=C(C=CC(=C1)C(C)(C)C)CCl

Isomeric SMILES

CC(C)C1=CC(=CC=C1)C(C)(C)C.CC(C)C1=C(C=CC(=C1)C(C)(C)C)CCl

InChI

InChI=1S/C14H21Cl.C13H20/c1-10(2)13-8-12(14(3,4)5)7-6-11(13)9-15;1-10(2)11-7-6-8-12(9-11)13(3,4)5/h6-8,10H,9H2,1-5H3;6-10H,1-5H3