ethyl 4-methyl-4-(3-phenylpropyl)piperazin-4-ium-1-carboxylate

Systemtic Name: ethyl 4-methyl-4-(3-phenylpropyl)piperazin-4-ium-1-carboxylate Openeye Name: ethyl 4-methyl-4-(3-phenylpropyl)piperazin-4-ium-1-carboxylate CAS Name: 4-methyl-4-(3-phenylpropyl)-1-piperazin-4-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 4-methyl-4-(3-phenylpropyl)piperazin-4-ium-1-carboxylate Traditional Name: 4-methyl-4-(3-phenylpropyl)piperazin-4-ium-1-carboxylic acid ethyl ester Formula: C17H27N2O2+ MolecularWeight: 291.40848

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CC[N+](CC1)(C)CCCC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)N1CC[N+](CC1)(C)CCCC2=CC=CC=C2

InChI

InChI=1S/C17H27N2O2/c1-3-21-17(20)18-11-14-19(2,15-12-18)13-7-10-16-8-5-4-6-9-16/h4-6,8-9H,3,7,10-15H2,1-2H3/q+1