furan-2-ylmethyl-[(1S)-1-(4-methyl-3-nitro-phenyl)ethyl]azanium

Systemtic Name: furan-2-ylmethyl-[(1S)-1-(4-methyl-3-nitro-phenyl)ethyl]azanium Openeye Name: 2-furylmethyl-[(1S)-1-(4-methyl-3-nitro-phenyl)ethyl]ammonium CAS Name: 2-furanylmethyl-[(1S)-1-(4-methyl-3-nitrophenyl)ethyl]ammonium IUPAC Name: furan-2-ylmethyl-[(1S)-1-(4-methyl-3-nitrophenyl)ethyl]azanium Traditional Name: 2-furfuryl-[(1S)-1-(4-methyl-3-nitro-phenyl)ethyl]ammonium Formula: C14H17N2O3+ MolecularWeight: 261.29638

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(C)[NH2+]CC2=CC=CO2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)[C@H](C)[NH2+]CC2=CC=CO2)[N+](=O)[O-]

InChI

InChI=1S/C14H16N2O3/c1-10-5-6-12(8-14(10)16(17)18)11(2)15-9-13-4-3-7-19-13/h3-8,11,15H,9H2,1-2H3/p+1/t11-/m0/s1