3-[1-[(2-methylpropan-2-yl)oxycarbonyl]-3-(naphthalen-2-ylmethoxy)piperidin-4-yl]benzoic acid

Systemtic Name: 3-[1-[(2-methylpropan-2-yl)oxycarbonyl]-3-(naphthalen-2-ylmethoxy)piperidin-4-yl]benzoic acid Openeye Name: 3-[1-tert-butoxycarbonyl-3-(2-naphthylmethoxy)-4-piperidyl]benzoic acid CAS Name: 3-[1-[(2-methylpropan-2-yl)oxy-oxomethyl]-3-(2-naphthalenylmethoxy)-4-piperidinyl]benzoic acid IUPAC Name: 3-[1-[(2-methylpropan-2-yl)oxycarbonyl]-3-(naphthalen-2-ylmethoxy)piperidin-4-yl]benzoic acid Traditional Name: 3-[1-tert-butoxycarbonyl-3-(2-naphthylmethoxy)-4-piperidyl]benzoic acid Formula: C28H31NO5 MolecularWeight: 461.54944

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(C(C1)OCC2=CC3=CC=CC=C3C=C2)C4=CC=CC(=C4)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(C(C1)OCC2=CC3=CC=CC=C3C=C2)C4=CC=CC(=C4)C(=O)O

InChI

InChI=1S/C28H31NO5/c1-28(2,3)34-27(32)29-14-13-24(22-9-6-10-23(16-22)26(30)31)25(17-29)33-18-19-11-12-20-7-4-5-8-21(20)15-19/h4-12,15-16,24-25H,13-14,17-18H2,1-3H3,(H,30,31)