methyl-[(5-methylfuran-2-yl)methyl]-[(2R)-1-oxidanylidene-1-[(phenylmethyl)amino]butan-2-yl]azanium

Systemtic Name: methyl-[(5-methylfuran-2-yl)methyl]-[(2R)-1-oxidanylidene-1-[(phenylmethyl)amino]butan-2-yl]azanium Openeye Name: [(1R)-1-(benzylcarbamoyl)propyl]-methyl-[(5-methyl-2-furyl)methyl]ammonium CAS Name: methyl-[(5-methyl-2-furanyl)methyl]-[(2R)-1-oxo-1-[(phenylmethyl)amino]butan-2-yl]ammonium IUPAC Name: [(2R)-1-(benzylamino)-1-oxobutan-2-yl]-methyl-[(5-methylfuran-2-yl)methyl]azanium Traditional Name: [(1R)-1-(benzylcarbamoyl)propyl]-methyl-[(5-methyl-2-furyl)methyl]ammonium Formula: C18H25N2O2+ MolecularWeight: 301.4033

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NCC1=CC=CC=C1)[NH+](C)CC2=CC=C(O2)C

Isomeric SMILES

CC[C@H](C(=O)NCC1=CC=CC=C1)[NH+](C)CC2=CC=C(O2)C

InChI

InChI=1S/C18H24N2O2/c1-4-17(20(3)13-16-11-10-14(2)22-16)18(21)19-12-15-8-6-5-7-9-15/h5-11,17H,4,12-13H2,1-3H3,(H,19,21)/p+1/t17-/m1/s1