2-(4,4-dimethyl-2-methylidene-pentyl)butanedioic acid; 2-(2-hydroxyethylamino)ethanol

Systemtic Name: 2-(4,4-dimethyl-2-methylidene-pentyl)butanedioic acid; 2-(2-hydroxyethylamino)ethanol Openeye Name: 2-(4,4-dimethyl-2-methylene-pentyl)butanedioic acid; 2-(2-hydroxyethylamino)ethanol CAS Name: 2-(4,4-dimethyl-2-methylenepentyl)butanedioic acid; 2-(2-hydroxyethylamino)ethanol IUPAC Name: 2-(4,4-dimethyl-2-methylidenepentyl)butanedioic acid; 2-(2-hydroxyethylamino)ethanol Traditional Name: 2-(2-hydroxyethylamino)ethanol; 2-(2-neopentylallyl)succinic acid Formula: C20H42N2O8 MolecularWeight: 438.55608

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(=C)CC(CC(=O)O)C(=O)O.C(CO)NCCO.C(CO)NCCO

Isomeric SMILES

CC(C)(C)CC(=C)CC(CC(=O)O)C(=O)O.C(CO)NCCO.C(CO)NCCO

InChI

InChI=1S/C12H20O4.2C4H11NO2/c1-8(7-12(2,3)4)5-9(11(15)16)6-10(13)14;2*6-3-1-5-2-4-7/h9H,1,5-7H2,2-4H3,(H,13,14)(H,15,16);2*5-7H,1-4H2