4-[4-[2-(1,3-dioxan-2-yl)ethyl]piperidin-1-yl]benzoic acid

Systemtic Name: 4-[4-[2-(1,3-dioxan-2-yl)ethyl]piperidin-1-yl]benzoic acid Openeye Name: 4-[4-[2-(1,3-dioxan-2-yl)ethyl]-1-piperidyl]benzoic acid CAS Name: 4-[4-[2-(1,3-dioxan-2-yl)ethyl]-1-piperidinyl]benzoic acid IUPAC Name: 4-[4-[2-(1,3-dioxan-2-yl)ethyl]piperidin-1-yl]benzoic acid Traditional Name: 4-[4-[2-(1,3-dioxan-2-yl)ethyl]piperidino]benzoic acid Formula: C18H25NO4 MolecularWeight: 319.3954

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(OC1)CCC2CCN(CC2)C3=CC=C(C=C3)C(=O)O

Isomeric SMILES

C1COC(OC1)CCC2CCN(CC2)C3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C18H25NO4/c20-18(21)15-3-5-16(6-4-15)19-10-8-14(9-11-19)2-7-17-22-12-1-13-23-17/h3-6,14,17H,1-2,7-13H2,(H,20,21)