N-cyclopropyl-2-[4-[4-(4-methylphenoxy)butanoyl]piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-cyclopropyl-2-[4-[4-(4-methylphenoxy)butanoyl]piperazin-1-ium-1-yl]ethanamide Openeye Name: N-cyclopropyl-2-[4-[4-(4-methylphenoxy)butanoyl]piperazin-1-ium-1-yl]acetamide CAS Name: N-cyclopropyl-2-[4-[4-(4-methylphenoxy)-1-oxobutyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-cyclopropyl-2-[4-[4-(4-methylphenoxy)butanoyl]piperazin-1-ium-1-yl]acetamide Traditional Name: N-cyclopropyl-2-[4-[4-(4-methylphenoxy)butanoyl]piperazin-1-ium-1-yl]acetamide Formula: C20H30N3O3+ MolecularWeight: 360.4705

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCCCC(=O)N2CC[NH+](CC2)CC(=O)NC3CC3

Isomeric SMILES

CC1=CC=C(C=C1)OCCCC(=O)N2CC[NH+](CC2)CC(=O)NC3CC3

InChI

InChI=1S/C20H29N3O3/c1-16-4-8-18(9-5-16)26-14-2-3-20(25)23-12-10-22(11-13-23)15-19(24)21-17-6-7-17/h4-5,8-9,17H,2-3,6-7,10-15H2,1H3,(H,21,24)/p+1