4-[4-(4-prop-2-ynoxyphenyl)piperazin-1-yl]butanoic acid

Systemtic Name: 4-[4-(4-prop-2-ynoxyphenyl)piperazin-1-yl]butanoic acid Openeye Name: 4-[4-(4-prop-2-ynoxyphenyl)piperazin-1-yl]butanoic acid CAS Name: 4-[4-(4-prop-2-ynoxyphenyl)-1-piperazinyl]butanoic acid IUPAC Name: 4-[4-(4-prop-2-ynoxyphenyl)piperazin-1-yl]butanoic acid Traditional Name: 4-[4-(4-propargyloxyphenyl)piperazino]butyric acid Formula: C17H22N2O3 MolecularWeight: 302.36818

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Descriptors Computed from Structure

Canonical SMILES:

C#CCOC1=CC=C(C=C1)N2CCN(CC2)CCCC(=O)O

Isomeric SMILES

C#CCOC1=CC=C(C=C1)N2CCN(CC2)CCCC(=O)O

InChI

InChI=1S/C17H22N2O3/c1-2-14-22-16-7-5-15(6-8-16)19-12-10-18(11-13-19)9-3-4-17(20)21/h1,5-8H,3-4,9-14H2,(H,20,21)