3-(4-prop-2-enylpiperazin-1-yl)benzoic acid

Systemtic Name: 3-(4-prop-2-enylpiperazin-1-yl)benzoic acid Openeye Name: 3-(4-allylpiperazin-1-yl)benzoic acid CAS Name: 3-(4-prop-2-enyl-1-piperazinyl)benzoic acid IUPAC Name: 3-(4-prop-2-enylpiperazin-1-yl)benzoic acid Traditional Name: 3-(4-allylpiperazino)benzoic acid Formula: C14H18N2O2 MolecularWeight: 246.30492

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1CCN(CC1)C2=CC=CC(=C2)C(=O)O

Isomeric SMILES

C=CCN1CCN(CC1)C2=CC=CC(=C2)C(=O)O

InChI

InChI=1S/C14H18N2O2/c1-2-6-15-7-9-16(10-8-15)13-5-3-4-12(11-13)14(17)18/h2-5,11H,1,6-10H2,(H,17,18)