2-(2-hydroxyethylamino)ethanol; 2-[(E)-6-methylhept-1-enyl]butanedioic acid

Systemtic Name: 2-(2-hydroxyethylamino)ethanol; 2-[(E)-6-methylhept-1-enyl]butanedioic acid Openeye Name: 2-(2-hydroxyethylamino)ethanol; 2-[(E)-6-methylhept-1-enyl]butanedioic acid CAS Name: 2-(2-hydroxyethylamino)ethanol; 2-[(E)-6-methylhept-1-enyl]butanedioic acid IUPAC Name: 2-(2-hydroxyethylamino)ethanol; 2-[(E)-6-methylhept-1-enyl]butanedioic acid Traditional Name: 2-(2-hydroxyethylamino)ethanol; 2-[(E)-6-methylhept-1-enyl]succinic acid Formula: C20H42N2O8 MolecularWeight: 438.55608

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H20O4.2C4H11NO2/c1-9(2)6-4-3-5-7-10(12(15)16)8-11(13)14;2*6-3-1-5-2-4-7/h5,7,9-10H,3-4,6,8H2,1-2H3,(H,13,14)(H,15,16);2*5-7H,1-4H2/b7-5+;;