(2R)-2-[4-[2-(cyclopropylamino)-2-oxidanylidene-ethyl]piperazin-4-ium-1-yl]-N-phenethyl-propanamide

Systemtic Name: (2R)-2-[4-[2-(cyclopropylamino)-2-oxidanylidene-ethyl]piperazin-4-ium-1-yl]-N-phenethyl-propanamide Openeye Name: (2R)-2-[4-[2-(cyclopropylamino)-2-oxo-ethyl]piperazin-4-ium-1-yl]-N-phenethyl-propanamide CAS Name: (2R)-2-[4-[2-(cyclopropylamino)-2-oxoethyl]-1-piperazin-4-iumyl]-N-phenethylpropanamide IUPAC Name: (2R)-2-[4-[2-(cyclopropylamino)-2-oxoethyl]piperazin-4-ium-1-yl]-N-phenethylpropanamide Traditional Name: (2R)-2-[4-[2-(cyclopropylamino)-2-keto-ethyl]piperazin-4-ium-1-yl]-N-phenethyl-propionamide Formula: C20H31N4O2+ MolecularWeight: 359.48574

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCCC1=CC=CC=C1)N2CC[NH+](CC2)CC(=O)NC3CC3

Isomeric SMILES

C[C@H](C(=O)NCCC1=CC=CC=C1)N2CC[NH+](CC2)CC(=O)NC3CC3

InChI

InChI=1S/C20H30N4O2/c1-16(20(26)21-10-9-17-5-3-2-4-6-17)24-13-11-23(12-14-24)15-19(25)22-18-7-8-18/h2-6,16,18H,7-15H2,1H3,(H,21,26)(H,22,25)/p+1/t16-/m1/s1