3-(pyridin-1-ium-1-ylmethylcarbamoyloxy)propyl 2-methoxy-3-(octadecan-4-ylcarbamoyloxy)piperidine-1-carboxylate

Systemtic Name: 3-(pyridin-1-ium-1-ylmethylcarbamoyloxy)propyl 2-methoxy-3-(octadecan-4-ylcarbamoyloxy)piperidine-1-carboxylate Openeye Name: 3-(pyridin-1-ium-1-ylmethylcarbamoyloxy)propyl 2-methoxy-3-(1-propylpentadecylcarbamoyloxy)piperidine-1-carboxylate CAS Name: 2-methoxy-3-[(octadecan-4-ylamino)-oxomethoxy]-1-piperidinecarboxylic acid 3-[oxo-(1-pyridin-1-iumylmethylamino)methoxy]propyl ester IUPAC Name: 3-(pyridin-1-ium-1-ylmethylcarbamoyloxy)propyl 2-methoxy-3-(octadecan-4-ylcarbamoyloxy)piperidine-1-carboxylate Traditional Name: 2-methoxy-3-(1-propylpentadecylcarbamoyloxy)piperidine-1-carboxylic acid 3-(pyridin-1-ium-1-ylmethylcarbamoyloxy)propyl ester Formula: C36H63N4O7+ MolecularWeight: 663.90802

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC(CCC)NC(=O)OC1CCCN(C1OC)C(=O)OCCCOC(=O)NC[N+]2=CC=CC=C2

Isomeric SMILES

CCCCCCCCCCCCCCC(CCC)NC(=O)OC1CCCN(C1OC)C(=O)OCCCOC(=O)NC[N+]2=CC=CC=C2

InChI

InChI=1S/C36H62N4O7/c1-4-6-7-8-9-10-11-12-13-14-15-17-23-31(22-5-2)38-35(42)47-32-24-20-27-40(33(32)44-3)36(43)46-29-21-28-45-34(41)37-30-39-25-18-16-19-26-39/h16,18-19,25-26,31-33H,4-15,17,20-24,27-30H2,1-3H3,(H-,37,38,41,42)/p+1