7-chloranylnaphthalene-1-carboxylate; indium(3+)

Systemtic Name: 7-chloranylnaphthalene-1-carboxylate; indium(3+) Openeye Name: 7-chloronaphthalene-1-carboxylate; indium(3+) CAS Name: 7-chloro-1-naphthalenecarboxylate; indium(3+) IUPAC Name: 7-chloronaphthalene-1-carboxylate; indium(3+) Traditional Name: 7-chloro-1-naphthoate; indium(3+) Formula: C33H18Cl3InO6 MolecularWeight: 731.66942

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C(C=C2)Cl)C(=C1)C(=O)[O-].C1=CC2=C(C=C(C=C2)Cl)C(=C1)C(=O)[O-].C1=CC2=C(C=C(C=C2)Cl)C(=C1)C(=O)[O-].[In+3]

Isomeric SMILES

C1=CC2=C(C=C(C=C2)Cl)C(=C1)C(=O)[O-].C1=CC2=C(C=C(C=C2)Cl)C(=C1)C(=O)[O-].C1=CC2=C(C=C(C=C2)Cl)C(=C1)C(=O)[O-].[In+3]

InChI

InChI=1S/3C11H7ClO2.In/c3*12-8-5-4-7-2-1-3-9(11(13)14)10(7)6-8;/h3*1-6H,(H,13,14);/q;;;+3/p-3