azanium (E)-2-(2-azanyl-2-oxidanylidene-ethyl)octadec-3-enoate

Systemtic Name: azanium (E)-2-(2-azanyl-2-oxidanylidene-ethyl)octadec-3-enoate Openeye Name: ammonium (E)-2-(2-amino-2-oxo-ethyl)octadec-3-enoate CAS Name: ammonium (E)-2-(2-amino-2-oxoethyl)-3-octadecenoate IUPAC Name: azanium (E)-2-(2-amino-2-oxoethyl)octadec-3-enoate Traditional Name: ammonium (E)-2-(2-amino-2-keto-ethyl)octadec-3-enoate Formula: C20H40N2O3 MolecularWeight: 356.5432

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC=CC(CC(=O)N)C(=O)[O-].[NH4+]

Isomeric SMILES

CCCCCCCCCCCCCC/C=C/C(CC(=O)N)C(=O)[O-].[NH4+]

InChI

InChI=1S/C20H37NO3.H3N/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-18(20(23)24)17-19(21)22;/h15-16,18H,2-14,17H2,1H3,(H2,21,22)(H,23,24);1H3/b16-15+;