1-[4-(furan-2-ylmethyl)piperazin-4-ium-1-yl]-3-(4-methoxyphenyl)propan-1-one

Systemtic Name: 1-[4-(furan-2-ylmethyl)piperazin-4-ium-1-yl]-3-(4-methoxyphenyl)propan-1-one Openeye Name: 1-[4-(2-furylmethyl)piperazin-4-ium-1-yl]-3-(4-methoxyphenyl)propan-1-one CAS Name: 1-[4-(2-furanylmethyl)-1-piperazin-4-iumyl]-3-(4-methoxyphenyl)-1-propanone IUPAC Name: 1-[4-(furan-2-ylmethyl)piperazin-4-ium-1-yl]-3-(4-methoxyphenyl)propan-1-one Traditional Name: 1-[4-(2-furfuryl)piperazin-4-ium-1-yl]-3-(4-methoxyphenyl)propan-1-one Formula: C19H25N2O3+ MolecularWeight: 329.4134

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCC(=O)N2CC[NH+](CC2)CC3=CC=CO3

Isomeric SMILES

COC1=CC=C(C=C1)CCC(=O)N2CC[NH+](CC2)CC3=CC=CO3

InChI

InChI=1S/C19H24N2O3/c1-23-17-7-4-16(5-8-17)6-9-19(22)21-12-10-20(11-13-21)15-18-3-2-14-24-18/h2-5,7-8,14H,6,9-13,15H2,1H3/p+1