(3R)-2-cyclohexylcarbonyl-3,4-dihydro-1H-isoquinoline-3-carboxylic acid

Systemtic Name: (3R)-2-cyclohexylcarbonyl-3,4-dihydro-1H-isoquinoline-3-carboxylic acid Openeye Name: (3R)-2-(cyclohexanecarbonyl)-3,4-dihydro-1H-isoquinoline-3-carboxylic acid CAS Name: (3R)-2-[cyclohexyl(oxo)methyl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid IUPAC Name: (3R)-2-(cyclohexanecarbonyl)-3,4-dihydro-1H-isoquinoline-3-carboxylic acid Traditional Name: (3R)-2-(cyclohexanecarbonyl)-3,4-dihydro-1H-isoquinoline-3-carboxylic acid Formula: C17H21NO3 MolecularWeight: 287.35354

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)N2CC3=CC=CC=C3CC2C(=O)O

Isomeric SMILES

C1CCC(CC1)C(=O)N2CC3=CC=CC=C3C[C@@H]2C(=O)O

InChI

InChI=1S/C17H21NO3/c19-16(12-6-2-1-3-7-12)18-11-14-9-5-4-8-13(14)10-15(18)17(20)21/h4-5,8-9,12,15H,1-3,6-7,10-11H2,(H,20,21)/t15-/m1/s1