4-methanidyl-3-(2-methoxy-4-methyl-benzene-6-id-1-yl)cyclohexane-1-carboxylic acid; yttrium(3+)

Systemtic Name: 4-methanidyl-3-(2-methoxy-4-methyl-benzene-6-id-1-yl)cyclohexane-1-carboxylic acid; yttrium(3+) Openeye Name: 4-methanidyl-3-(2-methoxy-4-methyl-benzene-6-id-1-yl)cyclohexanecarboxylic acid; yttrium(3+) CAS Name: 4-methanidyl-3-(2-methoxy-4-methyl-1-benzene-6-idyl)-1-cyclohexanecarboxylic acid; yttrium(3+) IUPAC Name: 4-methanidyl-3-(2-methoxy-4-methylbenzene-6-id-1-yl)cyclohexane-1-carboxylic acid; yttrium(3+) Traditional Name: 4-methanidyl-3-(2-methoxy-4-methyl-benzene-6-id-1-yl)cyclohexanecarboxylic acid; yttrium(3+) Formula: C16H20O3Y+ MolecularWeight: 349.23405

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C([C-]=C1)C2CC(CCC2[CH2-])C(=O)O)OC.[Y+3]

Isomeric SMILES

CC1=CC(=C([C-]=C1)C2CC(CCC2[CH2-])C(=O)O)OC.[Y+3]

InChI

InChI=1S/C16H20O3.Y/c1-10-4-7-13(15(8-10)19-3)14-9-12(16(17)18)6-5-11(14)2;/h4,8,11-12,14H,2,5-6,9H2,1,3H3,(H,17,18);/q-2;+3