3-[(1-ethylpyridin-1-ium-2-yl)methylcarbamoyloxy]propyl N-(2-methoxy-3-octadecan-3-yloxy-propyl)-N-(2-methoxyphenyl)carbonyl-carbamate

Systemtic Name: 3-[(1-ethylpyridin-1-ium-2-yl)methylcarbamoyloxy]propyl N-(2-methoxy-3-octadecan-3-yloxy-propyl)-N-(2-methoxyphenyl)carbonyl-carbamate Openeye Name: 3-[(1-ethylpyridin-1-ium-2-yl)methylcarbamoyloxy]propyl N-[3-(1-ethylhexadecoxy)-2-methoxy-propyl]-N-(2-methoxybenzoyl)carbamate CAS Name: N-(2-methoxy-3-octadecan-3-yloxypropyl)-N-[(2-methoxyphenyl)-oxomethyl]carbamic acid 3-[[(1-ethyl-2-pyridin-1-iumyl)methylamino]-oxomethoxy]propyl ester IUPAC Name: 3-[(1-ethylpyridin-1-ium-2-yl)methylcarbamoyloxy]propyl N-(2-methoxybenzoyl)-N-(2-methoxy-3-octadecan-3-yloxypropyl)carbamate Traditional Name: N-[3-(1-ethylhexadecoxy)-2-methoxy-propyl]-N-o-anisoyl-carbamic acid 3-[(1-ethylpyridin-1-ium-2-yl)methylcarbamoyloxy]propyl ester Formula: C43H70N3O8+ MolecularWeight: 757.0312

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(CC)OCC(CN(C(=O)C1=CC=CC=C1OC)C(=O)OCCCOC(=O)NCC2=CC=CC=[N+]2CC)OC

Isomeric SMILES

CCCCCCCCCCCCCCCC(CC)OCC(CN(C(=O)C1=CC=CC=C1OC)C(=O)OCCCOC(=O)NCC2=CC=CC=[N+]2CC)OC

InChI

InChI=1S/C43H69N3O8/c1-6-9-10-11-12-13-14-15-16-17-18-19-20-27-37(7-2)54-35-38(50-4)34-46(41(47)39-28-21-22-29-40(39)51-5)43(49)53-32-25-31-52-42(48)44-33-36-26-23-24-30-45(36)8-3/h21-24,26,28-30,37-38H,6-20,25,27,31-35H2,1-5H3/p+1