3-[(1,4-dimethoxynaphthalen-2-yl)methoxy]-4-(6-methylsulfonylpyridin-3-yl)piperidine-1-carboxylic acid

Systemtic Name: 3-[(1,4-dimethoxynaphthalen-2-yl)methoxy]-4-(6-methylsulfonylpyridin-3-yl)piperidine-1-carboxylic acid Openeye Name: 3-[(1,4-dimethoxy-2-naphthyl)methoxy]-4-(6-methylsulfonyl-3-pyridyl)piperidine-1-carboxylic acid CAS Name: 3-[(1,4-dimethoxy-2-naphthalenyl)methoxy]-4-(6-methylsulfonyl-3-pyridinyl)-1-piperidinecarboxylic acid IUPAC Name: 3-[(1,4-dimethoxynaphthalen-2-yl)methoxy]-4-(6-methylsulfonylpyridin-3-yl)piperidine-1-carboxylic acid Traditional Name: 3-[(1,4-dimethoxy-2-naphthyl)methoxy]-4-(6-mesyl-3-pyridyl)piperidine-1-carboxylic acid Formula: C25H28N2O7S MolecularWeight: 500.56402

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C2=CC=CC=C21)OC)COC3CN(CCC3C4=CN=C(C=C4)S(=O)(=O)C)C(=O)O

Isomeric SMILES

COC1=CC(=C(C2=CC=CC=C21)OC)COC3CN(CCC3C4=CN=C(C=C4)S(=O)(=O)C)C(=O)O

InChI

InChI=1S/C25H28N2O7S/c1-32-21-12-17(24(33-2)20-7-5-4-6-19(20)21)15-34-22-14-27(25(28)29)11-10-18(22)16-8-9-23(26-13-16)35(3,30)31/h4-9,12-13,18,22H,10-11,14-15H2,1-3H3,(H,28,29)