1-[(3S)-3-(furan-2-yl)-4-methyl-pentyl]-4-phenyl-piperazin-1-ium

Systemtic Name: 1-[(3S)-3-(furan-2-yl)-4-methyl-pentyl]-4-phenyl-piperazin-1-ium Openeye Name: 1-[(3S)-3-(2-furyl)-4-methyl-pentyl]-4-phenyl-piperazin-1-ium CAS Name: 1-[(3S)-3-(2-furanyl)-4-methylpentyl]-4-phenylpiperazin-1-ium IUPAC Name: 1-[(3S)-3-(furan-2-yl)-4-methylpentyl]-4-phenylpiperazin-1-ium Traditional Name: 1-[(3S)-3-(2-furyl)-4-methyl-pentyl]-4-phenyl-piperazin-1-ium Formula: C20H29N2O+ MolecularWeight: 313.45706

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CC[NH+]1CCN(CC1)C2=CC=CC=C2)C3=CC=CO3

Isomeric SMILES

CC(C)[C@H](CC[NH+]1CCN(CC1)C2=CC=CC=C2)C3=CC=CO3

InChI

InChI=1S/C20H28N2O/c1-17(2)19(20-9-6-16-23-20)10-11-21-12-14-22(15-13-21)18-7-4-3-5-8-18/h3-9,16-17,19H,10-15H2,1-2H3/p+1/t19-/m0/s1