[(E)-3-azanyl-4-oxidanyl-nonadec-5-enyl] 2-azanyl-3-methyl-butanoate

Systemtic Name: [(E)-3-azanyl-4-oxidanyl-nonadec-5-enyl] 2-azanyl-3-methyl-butanoate Openeye Name: [(E)-3-amino-4-hydroxy-nonadec-5-enyl] 2-amino-3-methyl-butanoate CAS Name: 2-amino-3-methylbutanoic acid [(E)-3-amino-4-hydroxynonadec-5-enyl] ester IUPAC Name: [(E)-3-amino-4-hydroxynonadec-5-enyl] 2-amino-3-methylbutanoate Traditional Name: 2-amino-3-methyl-butyric acid [(E)-3-amino-4-hydroxy-nonadec-5-enyl] ester Formula: C24H48N2O3 MolecularWeight: 412.64952

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC=CC(C(CCOC(=O)C(C(C)C)N)N)O

Isomeric SMILES

CCCCCCCCCCCCC/C=C/C(C(CCOC(=O)C(C(C)C)N)N)O

InChI

InChI=1S/C24H48N2O3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-22(27)21(25)18-19-29-24(28)23(26)20(2)3/h16-17,20-23,27H,4-15,18-19,25-26H2,1-3H3/b17-16+