1-(4-isocyanatooxypiperidin-1-yl)-N,2-dimethyl-1-(6-naphthalen-1-ylhexoxy)-N,6-bis(prop-2-enyl)piperidin-1-ium-4-amine

Systemtic Name: 1-(4-isocyanatooxypiperidin-1-yl)-N,2-dimethyl-1-(6-naphthalen-1-ylhexoxy)-N,6-bis(prop-2-enyl)piperidin-1-ium-4-amine Openeye Name: N,2-diallyl-1-(4-isocyanatooxy-1-piperidyl)-N,6-dimethyl-1-[6-(1-naphthyl)hexoxy]piperidin-1-ium-4-amine CAS Name: 1-(4-isocyanatooxy-1-piperidinyl)-N,2-dimethyl-1-[6-(1-naphthalenyl)hexoxy]-N,6-bis(prop-2-enyl)-4-piperidin-1-iumamine IUPAC Name: 1-(4-isocyanatooxypiperidin-1-yl)-N,2-dimethyl-1-(6-naphthalen-1-ylhexoxy)-N,6-bis(prop-2-enyl)piperidin-1-ium-4-amine Traditional Name: allyl-[2-allyl-1-(4-isocyanatooxypiperidino)-6-methyl-1-[6-(1-naphthyl)hexoxy]piperidin-1-ium-4-yl]-methyl-amine Formula: C35H51N4O3+ MolecularWeight: 575.80444

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CC([N+]1(N2CCC(CC2)ON=C=O)OCCCCCCC3=CC=CC4=CC=CC=C43)CC=C)N(C)CC=C

Isomeric SMILES

CC1CC(CC([N+]1(N2CCC(CC2)ON=C=O)OCCCCCCC3=CC=CC4=CC=CC=C43)CC=C)N(C)CC=C

InChI

InChI=1S/C35H51N4O3/c1-5-14-33-27-32(37(4)22-6-2)26-29(3)39(33,38-23-20-34(21-24-38)42-36-28-40)41-25-12-8-7-9-15-30-17-13-18-31-16-10-11-19-35(30)31/h5-6,10-11,13,16-19,29,32-34H,1-2,7-9,12,14-15,20-27H2,3-4H3/q+1