bis(2,4,6-trimethylphenyl)tin trihydrate

Systemtic Name: bis(2,4,6-trimethylphenyl)tin trihydrate Openeye Name: bis(2,4,6-trimethylphenyl)tin trihydrate CAS Name: bis(2,4,6-trimethylphenyl)tin trihydrate IUPAC Name: bis(2,4,6-trimethylphenyl)tin trihydrate Traditional Name: dimesityltin trihydrate Formula: C54H72O3Sn3 MolecularWeight: 1125.27768

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)[Sn]C2=C(C=C(C=C2C)C)C)C.CC1=CC(=C(C(=C1)C)[Sn]C2=C(C=C(C=C2C)C)C)C.CC1=CC(=C(C(=C1)C)[Sn]C2=C(C=C(C=C2C)C)C)C.O.O.O

Isomeric SMILES

CC1=CC(=C(C(=C1)C)[Sn]C2=C(C=C(C=C2C)C)C)C.CC1=CC(=C(C(=C1)C)[Sn]C2=C(C=C(C=C2C)C)C)C.CC1=CC(=C(C(=C1)C)[Sn]C2=C(C=C(C=C2C)C)C)C.O.O.O

InChI

InChI=1S/6C9H11.3H2O.3Sn/c6*1-7-4-8(2)6-9(3)5-7;;;;;;/h6*4-5H,1-3H3;3*1H2;;;