benzene hydrate

Systemtic Name: benzene hydrate Openeye Name: benzene hydrate CAS Name: benzene hydrate IUPAC Name: benzene hydrate Traditional Name: benzene hydrate Formula: C36H38O MolecularWeight: 486.68632

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=CC=C1.C1=CC=CC=C1.C1=CC=CC=C1.C1=CC=CC=C1.C1=CC=CC=C1.C1=CC=CC=C1.O

Isomeric SMILES

C1=CC=CC=C1.C1=CC=CC=C1.C1=CC=CC=C1.C1=CC=CC=C1.C1=CC=CC=C1.C1=CC=CC=C1.O

InChI

InChI=1S/6C6H6.H2O/c6*1-2-4-6-5-3-1;/h6*1-6H;1H2