2-phenylquinoline-4-carboxylic acid; tricyclohexyltin

Systemtic Name: 2-phenylquinoline-4-carboxylic acid; tricyclohexyltin Openeye Name: 2-phenylquinoline-4-carboxylic acid; tricyclohexyltin CAS Name: 2-phenyl-4-quinolinecarboxylic acid; tricyclohexyltin IUPAC Name: 2-phenylquinoline-4-carboxylic acid; tricyclohexyltin Traditional Name: 2-phenylcinchoninic acid; tricyclohexyltin Formula: C34H44NO2Sn MolecularWeight: 617.42866

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)[Sn](C2CCCCC2)C3CCCCC3.C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)O

Isomeric SMILES

C1CCC(CC1)[Sn](C2CCCCC2)C3CCCCC3.C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)O

InChI

InChI=1S/C16H11NO2.3C6H11.Sn/c18-16(19)13-10-15(11-6-2-1-3-7-11)17-14-9-5-4-8-12(13)14;3*1-2-4-6-5-3-1;/h1-10H,(H,18,19);3*1H,2-6H2;