8-azanyl-4-[(E)-3-pyridin-3-ylprop-2-enyl]octanoic acid

Systemtic Name: 8-azanyl-4-[(E)-3-pyridin-3-ylprop-2-enyl]octanoic acid Openeye Name: 8-amino-4-[(E)-3-(3-pyridyl)allyl]octanoic acid CAS Name: 8-amino-4-[(E)-3-(3-pyridinyl)prop-2-enyl]octanoic acid IUPAC Name: 8-amino-4-[(E)-3-pyridin-3-ylprop-2-enyl]octanoic acid Traditional Name: (E)-4-(4-aminobutyl)-7-(3-pyridyl)hept-6-enoic acid Formula: C16H24N2O2 MolecularWeight: 276.37396

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C=CCC(CCCCN)CCC(=O)O

Isomeric SMILES

C1=CC(=CN=C1)/C=C/CC(CCCCN)CCC(=O)O

InChI

InChI=1S/C16H24N2O2/c17-11-2-1-5-14(9-10-16(19)20)6-3-7-15-8-4-12-18-13-15/h3-4,7-8,12-14H,1-2,5-6,9-11,17H2,(H,19,20)/b7-3+