N-(4-ethoxyphenyl)-3-(4-phenylpiperazin-1-ium-1-yl)propanamide

Systemtic Name: N-(4-ethoxyphenyl)-3-(4-phenylpiperazin-1-ium-1-yl)propanamide Openeye Name: N-(4-ethoxyphenyl)-3-(4-phenylpiperazin-1-ium-1-yl)propanamide CAS Name: N-(4-ethoxyphenyl)-3-(4-phenyl-1-piperazin-1-iumyl)propanamide IUPAC Name: N-(4-ethoxyphenyl)-3-(4-phenylpiperazin-1-ium-1-yl)propanamide Traditional Name: 3-(4-phenylpiperazin-1-ium-1-yl)-N-p-phenetyl-propionamide Formula: C21H28N3O2+ MolecularWeight: 354.46592

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)CC[NH+]2CCN(CC2)C3=CC=CC=C3

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)CC[NH+]2CCN(CC2)C3=CC=CC=C3

InChI

InChI=1S/C21H27N3O2/c1-2-26-20-10-8-18(9-11-20)22-21(25)12-13-23-14-16-24(17-15-23)19-6-4-3-5-7-19/h3-11H,2,12-17H2,1H3,(H,22,25)/p+1