[4-[[4-(furan-2-ylcarbonyl)piperazin-1-yl]methyl]phenyl]methylazanium

Systemtic Name: [4-[[4-(furan-2-ylcarbonyl)piperazin-1-yl]methyl]phenyl]methylazanium Openeye Name: [4-[[4-(furan-2-carbonyl)piperazin-1-yl]methyl]phenyl]methylammonium CAS Name: [4-[[4-[2-furanyl(oxo)methyl]-1-piperazinyl]methyl]phenyl]methylammonium IUPAC Name: [4-[[4-(furan-2-carbonyl)piperazin-1-yl]methyl]phenyl]methylazanium Traditional Name: [4-[[4-(2-furoyl)piperazino]methyl]benzyl]ammonium Formula: C17H22N3O2+ MolecularWeight: 300.37548

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(C=C2)C[NH3+])C(=O)C3=CC=CO3

Isomeric SMILES

C1CN(CCN1CC2=CC=C(C=C2)C[NH3+])C(=O)C3=CC=CO3

InChI

InChI=1S/C17H21N3O2/c18-12-14-3-5-15(6-4-14)13-19-7-9-20(10-8-19)17(21)16-2-1-11-22-16/h1-6,11H,7-10,12-13,18H2/p+1