2-[bis(2-hydroxyethyl)amino]ethanol; 2-[(E)-dodec-1-enyl]butanedioic acid

Systemtic Name: 2-[bis(2-hydroxyethyl)amino]ethanol; 2-[(E)-dodec-1-enyl]butanedioic acid Openeye Name: 2-[bis(2-hydroxyethyl)amino]ethanol; 2-[(E)-dodec-1-enyl]butanedioic acid CAS Name: 2-[bis(2-hydroxyethyl)amino]ethanol; 2-[(E)-dodec-1-enyl]butanedioic acid IUPAC Name: 2-[bis(2-hydroxyethyl)amino]ethanol; 2-[(E)-dodec-1-enyl]butanedioic acid Traditional Name: 2-[bis(2-hydroxyethyl)amino]ethanol; 2-[(E)-dodec-1-enyl]succinic acid Formula: C22H43NO7 MolecularWeight: 433.57932

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC=CC(CC(=O)O)C(=O)O.C(CO)N(CCO)CCO

Isomeric SMILES

CCCCCCCCCC/C=C/C(CC(=O)O)C(=O)O.C(CO)N(CCO)CCO

InChI

InChI=1S/C16H28O4.C6H15NO3/c1-2-3-4-5-6-7-8-9-10-11-12-14(16(19)20)13-15(17)18;8-4-1-7(2-5-9)3-6-10/h11-12,14H,2-10,13H2,1H3,(H,17,18)(H,19,20);8-10H,1-6H2/b12-11+;