2-[(3R,5S)-3,5-dimethyl-1-[(phenethylamino)methyl]cyclohexyl]ethanoic acid

Systemtic Name: 2-[(3R,5S)-3,5-dimethyl-1-[(phenethylamino)methyl]cyclohexyl]ethanoic acid Openeye Name: 2-[(3R,5S)-3,5-dimethyl-1-[(phenethylamino)methyl]cyclohexyl]acetic acid CAS Name: 2-[(3R,5S)-3,5-dimethyl-1-[(phenethylamino)methyl]cyclohexyl]acetic acid IUPAC Name: 2-[(3R,5S)-3,5-dimethyl-1-[(phenethylamino)methyl]cyclohexyl]acetic acid Traditional Name: 2-[(3R,5S)-3,5-dimethyl-1-[(phenethylamino)methyl]cyclohexyl]acetic acid Formula: C19H29NO2 MolecularWeight: 303.43906

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CC(C1)(CC(=O)O)CNCCC2=CC=CC=C2)C

Isomeric SMILES

C[C@@H]1C[C@@H](CC(C1)(CC(=O)O)CNCCC2=CC=CC=C2)C

InChI

InChI=1S/C19H29NO2/c1-15-10-16(2)12-19(11-15,13-18(21)22)14-20-9-8-17-6-4-3-5-7-17/h3-7,15-16,20H,8-14H2,1-2H3,(H,21,22)/t15-,16+,19?