[4-[[5-(furan-2-ylcarbonylamino)-2-methyl-phenyl]amino]-4-oxidanylidene-butyl]azanium

Systemtic Name: [4-[[5-(furan-2-ylcarbonylamino)-2-methyl-phenyl]amino]-4-oxidanylidene-butyl]azanium Openeye Name: [4-[5-(furan-2-carbonylamino)-2-methyl-anilino]-4-oxo-butyl]ammonium CAS Name: [4-[5-[[2-furanyl(oxo)methyl]amino]-2-methylanilino]-4-oxobutyl]ammonium IUPAC Name: [4-[5-(furan-2-carbonylamino)-2-methylanilino]-4-oxobutyl]azanium Traditional Name: [4-[5-(2-furoylamino)-2-methyl-anilino]-4-keto-butyl]ammonium Formula: C16H20N3O3+ MolecularWeight: 302.3483

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC=CO2)NC(=O)CCC[NH3+]

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC=CO2)NC(=O)CCC[NH3+]

InChI

InChI=1S/C16H19N3O3/c1-11-6-7-12(18-16(21)14-4-3-9-22-14)10-13(11)19-15(20)5-2-8-17/h3-4,6-7,9-10H,2,5,8,17H2,1H3,(H,18,21)(H,19,20)/p+1