butane-1,4-diol; 3-(4-carboxyphenyl)-1,1,3-trimethyl-2H-indene-5-carboxylic acid; [4-(hydroxymethyl)cyclohexyl]methanol

Systemtic Name: butane-1,4-diol; 3-(4-carboxyphenyl)-1,1,3-trimethyl-2H-indene-5-carboxylic acid; [4-(hydroxymethyl)cyclohexyl]methanol Openeye Name: butane-1,4-diol; 3-(4-carboxyphenyl)-1,1,3-trimethyl-indane-5-carboxylic acid; [4-(hydroxymethyl)cyclohexyl]methanol CAS Name: butane-1,4-diol; 3-(4-carboxyphenyl)-1,1,3-trimethyl-2H-indene-5-carboxylic acid; [4-(hydroxymethyl)cyclohexyl]methanol IUPAC Name: butane-1,4-diol; 3-(4-carboxyphenyl)-1,1,3-trimethyl-2H-indene-5-carboxylic acid; [4-(hydroxymethyl)cyclohexyl]methanol Traditional Name: butane-1,4-diol; 3-(4-carboxyphenyl)-1,1,3-trimethyl-indane-5-carboxylic acid; (4-methylolcyclohexyl)methanol Formula: C32H46O8 MolecularWeight: 558.70284

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(C2=C1C=CC(=C2)C(=O)O)(C)C3=CC=C(C=C3)C(=O)O)C.C1CC(CCC1CO)CO.C(CCO)CO

Isomeric SMILES

CC1(CC(C2=C1C=CC(=C2)C(=O)O)(C)C3=CC=C(C=C3)C(=O)O)C.C1CC(CCC1CO)CO.C(CCO)CO

InChI

InChI=1S/C20H20O4.C8H16O2.C4H10O2/c1-19(2)11-20(3,14-7-4-12(5-8-14)17(21)22)16-10-13(18(23)24)6-9-15(16)19;9-5-7-1-2-8(6-10)4-3-7;5-3-1-2-4-6/h4-10H,11H2,1-3H3,(H,21,22)(H,23,24);7-10H,1-6H2;5-6H,1-4H2