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

Systemtic Name: ethyl 4-(3-phenylpropyl)piperazin-4-ium-1-carboxylate Openeye Name: ethyl 4-(3-phenylpropyl)piperazin-4-ium-1-carboxylate CAS Name: 4-(3-phenylpropyl)-1-piperazin-4-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 4-(3-phenylpropyl)piperazin-4-ium-1-carboxylate Traditional Name: 4-(3-phenylpropyl)piperazin-4-ium-1-carboxylic acid ethyl ester Formula: C16H25N2O2+ MolecularWeight: 277.3819

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H24N2O2/c1-2-20-16(19)18-13-11-17(12-14-18)10-6-9-15-7-4-3-5-8-15/h3-5,7-8H,2,6,9-14H2,1H3/p+1