3-(2-azanylethyl)-2-methyl-8-phenyl-octanoic acid

Systemtic Name: 3-(2-azanylethyl)-2-methyl-8-phenyl-octanoic acid Openeye Name: 3-(2-aminoethyl)-2-methyl-8-phenyl-octanoic acid CAS Name: 3-(2-aminoethyl)-2-methyl-8-phenyloctanoic acid IUPAC Name: 3-(2-aminoethyl)-2-methyl-8-phenyloctanoic acid Traditional Name: 3-(2-aminoethyl)-2-methyl-8-phenyl-caprylic acid Formula: C17H27NO2 MolecularWeight: 277.40178

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(CCCCCC1=CC=CC=C1)CCN)C(=O)O

Isomeric SMILES

CC(C(CCCCCC1=CC=CC=C1)CCN)C(=O)O

InChI

InChI=1S/C17H27NO2/c1-14(17(19)20)16(12-13-18)11-7-3-6-10-15-8-4-2-5-9-15/h2,4-5,8-9,14,16H,3,6-7,10-13,18H2,1H3,(H,19,20)