[2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-[(6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methyl]-methyl-azanium

Systemtic Name: [2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-[(6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methyl]-methyl-azanium Openeye Name: [2-(4-bromo-2-methyl-anilino)-2-oxo-ethyl]-[(6,7-dimethyl-2-oxo-chromen-4-yl)methyl]-methyl-ammonium CAS Name: [2-(4-bromo-2-methylanilino)-2-oxoethyl]-[(6,7-dimethyl-2-oxo-1-benzopyran-4-yl)methyl]-methylammonium IUPAC Name: [2-(4-bromo-2-methylanilino)-2-oxoethyl]-[(6,7-dimethyl-2-oxochromen-4-yl)methyl]-methylazanium Traditional Name: [2-(4-bromo-2-methyl-anilino)-2-keto-ethyl]-[(2-keto-6,7-dimethyl-chromen-4-yl)methyl]-methyl-ammonium Formula: C22H24BrN2O3+ MolecularWeight: 444.34156

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)C[NH+](C)CC2=CC(=O)OC3=CC(=C(C=C23)C)C

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)C[NH+](C)CC2=CC(=O)OC3=CC(=C(C=C23)C)C

InChI

InChI=1S/C22H23BrN2O3/c1-13-8-18-16(10-22(27)28-20(18)9-14(13)2)11-25(4)12-21(26)24-19-6-5-17(23)7-15(19)3/h5-10H,11-12H2,1-4H3,(H,24,26)/p+1