3-(aminomethyl)-5-methyl-8-phenyl-octanoic acid

Systemtic Name: 3-(aminomethyl)-5-methyl-8-phenyl-octanoic acid Openeye Name: 3-(aminomethyl)-5-methyl-8-phenyl-octanoic acid CAS Name: 3-(aminomethyl)-5-methyl-8-phenyloctanoic acid IUPAC Name: 3-(aminomethyl)-5-methyl-8-phenyloctanoic acid Traditional Name: 3-(aminomethyl)-5-methyl-8-phenyl-caprylic acid Formula: C16H25NO2 MolecularWeight: 263.3752

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCC1=CC=CC=C1)CC(CC(=O)O)CN

Isomeric SMILES

CC(CCCC1=CC=CC=C1)CC(CC(=O)O)CN

InChI

InChI=1S/C16H25NO2/c1-13(10-15(12-17)11-16(18)19)6-5-9-14-7-3-2-4-8-14/h2-4,7-8,13,15H,5-6,9-12,17H2,1H3,(H,18,19)