3,4-dimethylbenzoate; indium(3+)

Systemtic Name: 3,4-dimethylbenzoate; indium(3+) Openeye Name: 3,4-dimethylbenzoate; indium(3+) CAS Name: 3,4-dimethylbenzoate; indium(3+) IUPAC Name: 3,4-dimethylbenzoate; indium(3+) Traditional Name: 3,4-dimethylbenzoate; indium(3+) Formula: C27H27InO6 MolecularWeight: 562.31768

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)[O-])C.CC1=C(C=C(C=C1)C(=O)[O-])C.CC1=C(C=C(C=C1)C(=O)[O-])C.[In+3]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)[O-])C.CC1=C(C=C(C=C1)C(=O)[O-])C.CC1=C(C=C(C=C1)C(=O)[O-])C.[In+3]

InChI

InChI=1S/3C9H10O2.In/c3*1-6-3-4-8(9(10)11)5-7(6)2;/h3*3-5H,1-2H3,(H,10,11);/q;;;+3/p-3