2-[4-[(E)-3-(2,5-dimethoxyphenyl)prop-2-enoyl]piperazin-1-ium-1-yl]-N-propyl-ethanamide

Systemtic Name: 2-[4-[(E)-3-(2,5-dimethoxyphenyl)prop-2-enoyl]piperazin-1-ium-1-yl]-N-propyl-ethanamide Openeye Name: 2-[4-[(E)-3-(2,5-dimethoxyphenyl)prop-2-enoyl]piperazin-1-ium-1-yl]-N-propyl-acetamide CAS Name: 2-[4-[(E)-3-(2,5-dimethoxyphenyl)-1-oxoprop-2-enyl]-1-piperazin-1-iumyl]-N-propylacetamide IUPAC Name: 2-[4-[(E)-3-(2,5-dimethoxyphenyl)prop-2-enoyl]piperazin-1-ium-1-yl]-N-propylacetamide Traditional Name: 2-[4-[(E)-3-(2,5-dimethoxyphenyl)acryloyl]piperazin-1-ium-1-yl]-N-propyl-acetamide Formula: C20H30N3O4+ MolecularWeight: 376.4699

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C[NH+]1CCN(CC1)C(=O)C=CC2=C(C=CC(=C2)OC)OC

Isomeric SMILES

CCCNC(=O)C[NH+]1CCN(CC1)C(=O)/C=C/C2=C(C=CC(=C2)OC)OC

InChI

InChI=1S/C20H29N3O4/c1-4-9-21-19(24)15-22-10-12-23(13-11-22)20(25)8-5-16-14-17(26-2)6-7-18(16)27-3/h5-8,14H,4,9-13,15H2,1-3H3,(H,21,24)/p+1/b8-5+