ethyl 4-[[4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-yl]carbonylamino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[[4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-yl]carbonylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[[4-(1-naphthylmethyl)piperazin-4-ium-1-carbonyl]amino]piperidine-1-carboxylate CAS Name: 4-[[[4-(1-naphthalenylmethyl)-1-piperazin-4-iumyl]-oxomethyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-carbonyl]amino]piperidine-1-carboxylate Traditional Name: 4-[[4-(1-naphthylmethyl)piperazin-4-ium-1-carbonyl]amino]piperidine-1-carboxylic acid ethyl ester Formula: C24H33N4O3+ MolecularWeight: 425.54382

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)N2CC[NH+](CC2)CC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=O)N2CC[NH+](CC2)CC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C24H32N4O3/c1-2-31-24(30)28-12-10-21(11-13-28)25-23(29)27-16-14-26(15-17-27)18-20-8-5-7-19-6-3-4-9-22(19)20/h3-9,21H,2,10-18H2,1H3,(H,25,29)/p+1