[2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-[(3-ethoxycarbonylfuran-2-yl)methyl]-methyl-azanium

Systemtic Name: [2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-[(3-ethoxycarbonylfuran-2-yl)methyl]-methyl-azanium Openeye Name: [2-(4-bromo-2-methyl-anilino)-2-oxo-ethyl]-[(3-ethoxycarbonyl-2-furyl)methyl]-methyl-ammonium CAS Name: [2-(4-bromo-2-methylanilino)-2-oxoethyl]-[(3-ethoxycarbonyl-2-furanyl)methyl]-methylammonium IUPAC Name: [2-(4-bromo-2-methylanilino)-2-oxoethyl]-[(3-ethoxycarbonylfuran-2-yl)methyl]-methylazanium Traditional Name: [2-(4-bromo-2-methyl-anilino)-2-keto-ethyl]-[(3-carbethoxy-2-furyl)methyl]-methyl-ammonium Formula: C18H22BrN2O4+ MolecularWeight: 410.28228

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC=C1)C[NH+](C)CC(=O)NC2=C(C=C(C=C2)Br)C

Isomeric SMILES

CCOC(=O)C1=C(OC=C1)C[NH+](C)CC(=O)NC2=C(C=C(C=C2)Br)C

InChI

InChI=1S/C18H21BrN2O4/c1-4-24-18(23)14-7-8-25-16(14)10-21(3)11-17(22)20-15-6-5-13(19)9-12(15)2/h5-9H,4,10-11H2,1-3H3,(H,20,22)/p+1