3-[heptyl-(2-oxidanyl-3-prop-2-enoxy-propyl)amino]propanoic acid

Systemtic Name: 3-[heptyl-(2-oxidanyl-3-prop-2-enoxy-propyl)amino]propanoic acid Openeye Name: 3-[(3-allyloxy-2-hydroxy-propyl)-heptyl-amino]propanoic acid CAS Name: 3-[heptyl-(2-hydroxy-3-prop-2-enoxypropyl)amino]propanoic acid IUPAC Name: 3-[heptyl-(2-hydroxy-3-prop-2-enoxypropyl)amino]propanoic acid Traditional Name: 3-[(3-allyloxy-2-hydroxy-propyl)-heptyl-amino]propionic acid Formula: C16H31NO4 MolecularWeight: 301.42164

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN(CCC(=O)O)CC(COCC=C)O

Isomeric SMILES

CCCCCCCN(CCC(=O)O)CC(COCC=C)O

InChI

InChI=1S/C16H31NO4/c1-3-5-6-7-8-10-17(11-9-16(19)20)13-15(18)14-21-12-4-2/h4,15,18H,2-3,5-14H2,1H3,(H,19,20)