4-[2-[methyl(4-phenylbutyl)amino]pyrimidin-5-yl]-3-(naphthalen-2-ylmethoxy)piperidine-1-carboxylic acid

Systemtic Name: 4-[2-[methyl(4-phenylbutyl)amino]pyrimidin-5-yl]-3-(naphthalen-2-ylmethoxy)piperidine-1-carboxylic acid Openeye Name: 4-[2-[methyl(4-phenylbutyl)amino]pyrimidin-5-yl]-3-(2-naphthylmethoxy)piperidine-1-carboxylic acid CAS Name: 4-[2-[methyl(4-phenylbutyl)amino]-5-pyrimidinyl]-3-(2-naphthalenylmethoxy)-1-piperidinecarboxylic acid IUPAC Name: 4-[2-[methyl(4-phenylbutyl)amino]pyrimidin-5-yl]-3-(naphthalen-2-ylmethoxy)piperidine-1-carboxylic acid Traditional Name: 4-[2-[methyl(4-phenylbutyl)amino]pyrimidin-5-yl]-3-(2-naphthylmethoxy)piperidine-1-carboxylic acid Formula: C32H36N4O3 MolecularWeight: 524.65324

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCCC1=CC=CC=C1)C2=NC=C(C=N2)C3CCN(CC3OCC4=CC5=CC=CC=C5C=C4)C(=O)O

Isomeric SMILES

CN(CCCCC1=CC=CC=C1)C2=NC=C(C=N2)C3CCN(CC3OCC4=CC5=CC=CC=C5C=C4)C(=O)O

InChI

InChI=1S/C32H36N4O3/c1-35(17-8-7-11-24-9-3-2-4-10-24)31-33-20-28(21-34-31)29-16-18-36(32(37)38)22-30(29)39-23-25-14-15-26-12-5-6-13-27(26)19-25/h2-6,9-10,12-15,19-21,29-30H,7-8,11,16-18,22-23H2,1H3,(H,37,38)