1-[(4-methoxy-2-methyl-5-propan-2-yl-phenyl)methyl]piperidine-3-carboxylic acid

Systemtic Name: 1-[(4-methoxy-2-methyl-5-propan-2-yl-phenyl)methyl]piperidine-3-carboxylic acid Openeye Name: 1-[(5-isopropyl-4-methoxy-2-methyl-phenyl)methyl]piperidine-3-carboxylic acid CAS Name: 1-[(4-methoxy-2-methyl-5-propan-2-ylphenyl)methyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[(4-methoxy-2-methyl-5-propan-2-ylphenyl)methyl]piperidine-3-carboxylic acid Traditional Name: 1-(5-isopropyl-4-methoxy-2-methyl-benzyl)nipecotic acid Formula: C18H27NO3 MolecularWeight: 305.41188

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1CN2CCCC(C2)C(=O)O)C(C)C)OC

Isomeric SMILES

CC1=CC(=C(C=C1CN2CCCC(C2)C(=O)O)C(C)C)OC

InChI

InChI=1S/C18H27NO3/c1-12(2)16-9-15(13(3)8-17(16)22-4)11-19-7-5-6-14(10-19)18(20)21/h8-9,12,14H,5-7,10-11H2,1-4H3,(H,20,21)