3-azanyl-8-(3-chlorophenyl)-4-ethyl-6-methyl-octanoic acid

Systemtic Name: 3-azanyl-8-(3-chlorophenyl)-4-ethyl-6-methyl-octanoic acid Openeye Name: 3-amino-8-(3-chlorophenyl)-4-ethyl-6-methyl-octanoic acid CAS Name: 3-amino-8-(3-chlorophenyl)-4-ethyl-6-methyloctanoic acid IUPAC Name: 3-amino-8-(3-chlorophenyl)-4-ethyl-6-methyloctanoic acid Traditional Name: 3-amino-8-(3-chlorophenyl)-4-ethyl-6-methyl-caprylic acid Formula: C17H26ClNO2 MolecularWeight: 311.84684

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC(C)CCC1=CC(=CC=C1)Cl)C(CC(=O)O)N

Isomeric SMILES

CCC(CC(C)CCC1=CC(=CC=C1)Cl)C(CC(=O)O)N

InChI

InChI=1S/C17H26ClNO2/c1-3-14(16(19)11-17(20)21)9-12(2)7-8-13-5-4-6-15(18)10-13/h4-6,10,12,14,16H,3,7-9,11,19H2,1-2H3,(H,20,21)