[(1S)-1-[5-[(2-ethyl-6-methyl-phenyl)carbamoyl]furan-2-yl]ethyl]azanium

Systemtic Name: [(1S)-1-[5-[(2-ethyl-6-methyl-phenyl)carbamoyl]furan-2-yl]ethyl]azanium Openeye Name: [(1S)-1-[5-[(2-ethyl-6-methyl-phenyl)carbamoyl]-2-furyl]ethyl]ammonium CAS Name: [(1S)-1-[5-[(2-ethyl-6-methylanilino)-oxomethyl]-2-furanyl]ethyl]ammonium IUPAC Name: [(1S)-1-[5-[(2-ethyl-6-methylphenyl)carbamoyl]furan-2-yl]ethyl]azanium Traditional Name: [(1S)-1-[5-[(2-ethyl-6-methyl-phenyl)carbamoyl]-2-furyl]ethyl]ammonium Formula: C16H21N2O2+ MolecularWeight: 273.35014

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=O)C2=CC=C(O2)C(C)[NH3+])C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)C2=CC=C(O2)[C@H](C)[NH3+])C

InChI

InChI=1S/C16H20N2O2/c1-4-12-7-5-6-10(2)15(12)18-16(19)14-9-8-13(20-14)11(3)17/h5-9,11H,4,17H2,1-3H3,(H,18,19)/p+1/t11-/m0/s1