(2E)-2-[[(4-azanyl-3-oxidanyl-butyl)-hexyl-amino]methylidene]butanoate

Systemtic Name: (2E)-2-[[(4-azanyl-3-oxidanyl-butyl)-hexyl-amino]methylidene]butanoate Openeye Name: (2E)-2-[[(4-amino-3-hydroxy-butyl)-hexyl-amino]methylene]butanoate CAS Name: (2E)-2-[[(4-amino-3-hydroxybutyl)-hexylamino]methylidene]butanoate IUPAC Name: (2E)-2-[[(4-amino-3-hydroxybutyl)-hexylamino]methylidene]butanoate Traditional Name: (E)-3-[(4-amino-3-hydroxy-butyl)-hexyl-amino]-2-ethyl-acrylate Formula: C15H29N2O3- MolecularWeight: 285.40236

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN(CCC(CN)O)C=C(CC)C(=O)[O-]

Isomeric SMILES

CCCCCCN(CCC(CN)O)/C=C(\CC)/C(=O)[O-]

InChI

InChI=1S/C15H30N2O3/c1-3-5-6-7-9-17(10-8-14(18)11-16)12-13(4-2)15(19)20/h12,14,18H,3-11,16H2,1-2H3,(H,19,20)/p-1/b13-12+