benzene; phenol; propan-2-ylbenzene

Systemtic Name: benzene; phenol; propan-2-ylbenzene Openeye Name: benzene; cumene; phenol CAS Name: benzene; cumene; phenol IUPAC Name: benzene; cumene; phenol Traditional Name: benzene; cumene; phenol Formula: C21H24O MolecularWeight: 292.41466

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H12.C6H6O.C6H6/c1-8(2)9-6-4-3-5-7-9;7-6-4-2-1-3-5-6;1-2-4-6-5-3-1/h3-8H,1-2H3;1-5,7H;1-6H