3-(naphthalen-2-ylmethoxy)-4-[2-(3-phenylmethoxypropylamino)pyrimidin-5-yl]piperidine-1-carboxylate

Systemtic Name: 3-(naphthalen-2-ylmethoxy)-4-[2-(3-phenylmethoxypropylamino)pyrimidin-5-yl]piperidine-1-carboxylate Openeye Name: 4-[2-(3-benzyloxypropylamino)pyrimidin-5-yl]-3-(2-naphthylmethoxy)piperidine-1-carboxylate CAS Name: 3-(2-naphthalenylmethoxy)-4-[2-(3-phenylmethoxypropylamino)-5-pyrimidinyl]-1-piperidinecarboxylate IUPAC Name: 3-(naphthalen-2-ylmethoxy)-4-[2-(3-phenylmethoxypropylamino)pyrimidin-5-yl]piperidine-1-carboxylate Traditional Name: 4-[2-(3-benzoxypropylamino)pyrimidin-5-yl]-3-(2-naphthylmethoxy)piperidine-1-carboxylate Formula: C31H33N4O4- MolecularWeight: 525.61812

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(C1C2=CN=C(N=C2)NCCCOCC3=CC=CC=C3)OCC4=CC5=CC=CC=C5C=C4)C(=O)[O-]

Isomeric SMILES

C1CN(CC(C1C2=CN=C(N=C2)NCCCOCC3=CC=CC=C3)OCC4=CC5=CC=CC=C5C=C4)C(=O)[O-]

InChI

InChI=1S/C31H34N4O4/c36-31(37)35-15-13-28(29(20-35)39-22-24-11-12-25-9-4-5-10-26(25)17-24)27-18-33-30(34-19-27)32-14-6-16-38-21-23-7-2-1-3-8-23/h1-5,7-12,17-19,28-29H,6,13-16,20-22H2,(H,36,37)(H,32,33,34)/p-1