2-[4-[2-(3-methoxypropylamino)-2-oxidanylidene-ethyl]piperazin-1-ium-1-yl]-N-(phenylmethyl)ethanamide

Systemtic Name: 2-[4-[2-(3-methoxypropylamino)-2-oxidanylidene-ethyl]piperazin-1-ium-1-yl]-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-[4-[2-(3-methoxypropylamino)-2-oxo-ethyl]piperazin-1-ium-1-yl]acetamide CAS Name: 2-[4-[2-(3-methoxypropylamino)-2-oxoethyl]-1-piperazin-1-iumyl]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[4-[2-(3-methoxypropylamino)-2-oxoethyl]piperazin-1-ium-1-yl]acetamide Traditional Name: N-benzyl-2-[4-[2-keto-2-(3-methoxypropylamino)ethyl]piperazin-1-ium-1-yl]acetamide Formula: C19H31N4O3+ MolecularWeight: 363.47444

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Descriptors Computed from Structure

Canonical SMILES:

COCCCNC(=O)CN1CC[NH+](CC1)CC(=O)NCC2=CC=CC=C2

Isomeric SMILES

COCCCNC(=O)CN1CC[NH+](CC1)CC(=O)NCC2=CC=CC=C2

InChI

InChI=1S/C19H30N4O3/c1-26-13-5-8-20-18(24)15-22-9-11-23(12-10-22)16-19(25)21-14-17-6-3-2-4-7-17/h2-4,6-7H,5,8-16H2,1H3,(H,20,24)(H,21,25)/p+1