N-(1,3-benzodioxol-5-yl)-3-(4-phenylpiperazin-1-ium-1-yl)propanamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-3-(4-phenylpiperazin-1-ium-1-yl)propanamide Openeye Name: N-(1,3-benzodioxol-5-yl)-3-(4-phenylpiperazin-1-ium-1-yl)propanamide CAS Name: N-(1,3-benzodioxol-5-yl)-3-(4-phenyl-1-piperazin-1-iumyl)propanamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-3-(4-phenylpiperazin-1-ium-1-yl)propanamide Traditional Name: N-(1,3-benzodioxol-5-yl)-3-(4-phenylpiperazin-1-ium-1-yl)propionamide Formula: C20H24N3O3+ MolecularWeight: 354.42286

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCC(=O)NC2=CC3=C(C=C2)OCO3)C4=CC=CC=C4

Isomeric SMILES

C1CN(CC[NH+]1CCC(=O)NC2=CC3=C(C=C2)OCO3)C4=CC=CC=C4

InChI

InChI=1S/C20H23N3O3/c24-20(21-16-6-7-18-19(14-16)26-15-25-18)8-9-22-10-12-23(13-11-22)17-4-2-1-3-5-17/h1-7,14H,8-13,15H2,(H,21,24)/p+1