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

Systemtic Name: azanium (E)-2-(2-azanyl-2-oxidanylidene-ethyl)hexadec-3-enoate Openeye Name: ammonium (E)-2-(2-amino-2-oxo-ethyl)hexadec-3-enoate CAS Name: ammonium (E)-2-(2-amino-2-oxoethyl)-3-hexadecenoate IUPAC Name: azanium (E)-2-(2-amino-2-oxoethyl)hexadec-3-enoate Traditional Name: ammonium (E)-2-(2-amino-2-keto-ethyl)hexadec-3-enoate Formula: C18H36N2O3 MolecularWeight: 328.49004

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H33NO3.H3N/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-16(18(21)22)15-17(19)20;/h13-14,16H,2-12,15H2,1H3,(H2,19,20)(H,21,22);1H3/b14-13+;