3-[[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-3-yl]methyl]benzoic acid

Systemtic Name: 3-[[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-3-yl]methyl]benzoic acid Openeye Name: 3-[(1-tert-butoxycarbonyl-3-piperidyl)methyl]benzoic acid CAS Name: 3-[[1-[(2-methylpropan-2-yl)oxy-oxomethyl]-3-piperidinyl]methyl]benzoic acid IUPAC Name: 3-[[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-3-yl]methyl]benzoic acid Traditional Name: 3-[(1-tert-butoxycarbonyl-3-piperidyl)methyl]benzoic acid Formula: C18H25NO4 MolecularWeight: 319.3954

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC(C1)CC2=CC=CC(=C2)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCC(C1)CC2=CC=CC(=C2)C(=O)O

InChI

InChI=1S/C18H25NO4/c1-18(2,3)23-17(22)19-9-5-7-14(12-19)10-13-6-4-8-15(11-13)16(20)21/h4,6,8,11,14H,5,7,9-10,12H2,1-3H3,(H,20,21)