3-(aminomethyl)-4-propan-2-yl-octanoic acid

Systemtic Name: 3-(aminomethyl)-4-propan-2-yl-octanoic acid Openeye Name: 3-(aminomethyl)-4-isopropyl-octanoic acid CAS Name: 3-(aminomethyl)-4-propan-2-yloctanoic acid IUPAC Name: 3-(aminomethyl)-4-propan-2-yloctanoic acid Traditional Name: 3-(aminomethyl)-4-isopropyl-caprylic acid Formula: C12H25NO2 MolecularWeight: 215.3324

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(C)C)C(CC(=O)O)CN

Isomeric SMILES

CCCCC(C(C)C)C(CC(=O)O)CN

InChI

InChI=1S/C12H25NO2/c1-4-5-6-11(9(2)3)10(8-13)7-12(14)15/h9-11H,4-8,13H2,1-3H3,(H,14,15)