prop-2-enyl 6-(4-phenylpiperazin-1-yl)pyridin-1-ium-3-carboxylate

Systemtic Name: prop-2-enyl 6-(4-phenylpiperazin-1-yl)pyridin-1-ium-3-carboxylate Openeye Name: allyl 6-(4-phenylpiperazin-1-yl)pyridin-1-ium-3-carboxylate CAS Name: 6-(4-phenyl-1-piperazinyl)-3-pyridin-1-iumcarboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 6-(4-phenylpiperazin-1-yl)pyridin-1-ium-3-carboxylate Traditional Name: 6-(4-phenylpiperazino)pyridin-1-ium-3-carboxylic acid allyl ester Formula: C19H22N3O2+ MolecularWeight: 324.39688

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC(=O)C1=C[NH+]=C(C=C1)N2CCN(CC2)C3=CC=CC=C3

Isomeric SMILES

C=CCOC(=O)C1=C[NH+]=C(C=C1)N2CCN(CC2)C3=CC=CC=C3

InChI

InChI=1S/C19H21N3O2/c1-2-14-24-19(23)16-8-9-18(20-15-16)22-12-10-21(11-13-22)17-6-4-3-5-7-17/h2-9,15H,1,10-14H2/p+1