ethyl 4-[(Z)-2-chloranyl-3-phenyl-prop-2-enyl]piperazin-4-ium-1-carboxylate

Systemtic Name: ethyl 4-[(Z)-2-chloranyl-3-phenyl-prop-2-enyl]piperazin-4-ium-1-carboxylate Openeye Name: ethyl 4-[(Z)-2-chloro-3-phenyl-allyl]piperazin-4-ium-1-carboxylate CAS Name: 4-[(Z)-2-chloro-3-phenylprop-2-enyl]-1-piperazin-4-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(Z)-2-chloro-3-phenylprop-2-enyl]piperazin-4-ium-1-carboxylate Traditional Name: 4-[(Z)-2-chloro-3-phenyl-allyl]piperazin-4-ium-1-carboxylic acid ethyl ester Formula: C16H22ClN2O2+ MolecularWeight: 309.81108

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CC[NH+](CC1)CC(=CC2=CC=CC=C2)Cl

Isomeric SMILES

CCOC(=O)N1CC[NH+](CC1)C/C(=C/C2=CC=CC=C2)/Cl

InChI

InChI=1S/C16H21ClN2O2/c1-2-21-16(20)19-10-8-18(9-11-19)13-15(17)12-14-6-4-3-5-7-14/h3-7,12H,2,8-11,13H2,1H3/p+1/b15-12-