(2-azanyl-2-phenyl-cyclohexyl) 3,5-dimethylbenzoate

Systemtic Name: (2-azanyl-2-phenyl-cyclohexyl) 3,5-dimethylbenzoate Openeye Name: (2-amino-2-phenyl-cyclohexyl) 3,5-dimethylbenzoate CAS Name: 3,5-dimethylbenzoic acid (2-amino-2-phenylcyclohexyl) ester IUPAC Name: (2-amino-2-phenylcyclohexyl) 3,5-dimethylbenzoate Traditional Name: 3,5-dimethylbenzoic acid (2-amino-2-phenyl-cyclohexyl) ester Formula: C21H25NO2 MolecularWeight: 323.4287

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C(=O)OC2CCCCC2(C3=CC=CC=C3)N)C

Isomeric SMILES

CC1=CC(=CC(=C1)C(=O)OC2CCCCC2(C3=CC=CC=C3)N)C

InChI

InChI=1S/C21H25NO2/c1-15-12-16(2)14-17(13-15)20(23)24-19-10-6-7-11-21(19,22)18-8-4-3-5-9-18/h3-5,8-9,12-14,19H,6-7,10-11,22H2,1-2H3