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2-aminocarbonyl-8-(3,4-dimethylphenyl)-2-methyl-octanoic acid

2-aminocarbonyl-8-(3,4-dimethylphenyl)-2-methyl-octanoic acid

Systemtic Name:2-aminocarbonyl-8-(3,4-dimethylphenyl)-2-methyl-octanoic acid
Openeye Name:2-carbamoyl-8-(3,4-dimethylphenyl)-2-methyl-octanoic acid
CAS Name:2-carbamoyl-8-(3,4-dimethylphenyl)-2-methyloctanoic acid
IUPAC Name:2-carbamoyl-8-(3,4-dimethylphenyl)-2-methyloctanoic acid
Traditional Name:2-carbamoyl-8-(3,4-dimethylphenyl)-2-methyl-caprylic acid
Formula: C18H27NO3
MolecularWeight: 305.41188
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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CCCCCCC(C)(C(=O)N)C(=O)O)C


Isomeric SMILES

CC1=C(C=C(C=C1)CCCCCCC(C)(C(=O)N)C(=O)O)C


InChI

InChI=1S/C18H27NO3/c1-13-9-10-15(12-14(13)2)8-6-4-5-7-11-18(3,16(19)20)17(21)22/h9-10,12H,4-8,11H2,1-3H3,(H2,19,20)(H,21,22)


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