3-iodyl-4,5,6-trimethyl-naphthalene-2-carboxylic acid

Systemtic Name: 3-iodyl-4,5,6-trimethyl-naphthalene-2-carboxylic acid Openeye Name: 3-iodyl-4,5,6-trimethyl-naphthalene-2-carboxylic acid CAS Name: 3-iodyl-4,5,6-trimethyl-2-naphthalenecarboxylic acid IUPAC Name: 3-iodyl-4,5,6-trimethylnaphthalene-2-carboxylic acid Traditional Name: 3-iodyl-4,5,6-trimethyl-2-naphthoic acid Formula: C14H13IO4 MolecularWeight: 372.15509

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C(=C(C=C2C=C1)C(=O)O)I(=O)=O)C)C

Isomeric SMILES

CC1=C(C2=C(C(=C(C=C2C=C1)C(=O)O)I(=O)=O)C)C

InChI

InChI=1S/C14H13IO4/c1-7-4-5-10-6-11(14(16)17)13(15(18)19)9(3)12(10)8(7)2/h4-6H,1-3H3,(H,16,17)