2-[1-[2-azanyl-2-(3,4-dimethylphenyl)ethyl]cyclohexyl]ethanoic acid

Systemtic Name: 2-[1-[2-azanyl-2-(3,4-dimethylphenyl)ethyl]cyclohexyl]ethanoic acid Openeye Name: 2-[1-[2-amino-2-(3,4-dimethylphenyl)ethyl]cyclohexyl]acetic acid CAS Name: 2-[1-[2-amino-2-(3,4-dimethylphenyl)ethyl]cyclohexyl]acetic acid IUPAC Name: 2-[1-[2-amino-2-(3,4-dimethylphenyl)ethyl]cyclohexyl]acetic acid Traditional Name: 2-[1-[2-amino-2-(3,4-dimethylphenyl)ethyl]cyclohexyl]acetic acid Formula: C18H27NO2 MolecularWeight: 289.41248

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(CC2(CCCCC2)CC(=O)O)N)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(CC2(CCCCC2)CC(=O)O)N)C

InChI

InChI=1S/C18H27NO2/c1-13-6-7-15(10-14(13)2)16(19)11-18(12-17(20)21)8-4-3-5-9-18/h6-7,10,16H,3-5,8-9,11-12,19H2,1-2H3,(H,20,21)