(6-chloranyl-7-methyl-2-oxidanylidene-chromen-4-yl)methyl-[2-(dimethylamino)-2-oxidanylidene-ethyl]-methyl-azanium

Systemtic Name: (6-chloranyl-7-methyl-2-oxidanylidene-chromen-4-yl)methyl-[2-(dimethylamino)-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: (6-chloro-7-methyl-2-oxo-chromen-4-yl)methyl-[2-(dimethylamino)-2-oxo-ethyl]-methyl-ammonium CAS Name: (6-chloro-7-methyl-2-oxo-1-benzopyran-4-yl)methyl-[2-(dimethylamino)-2-oxoethyl]-methylammonium IUPAC Name: (6-chloro-7-methyl-2-oxochromen-4-yl)methyl-[2-(dimethylamino)-2-oxoethyl]-methylazanium Traditional Name: (6-chloro-2-keto-7-methyl-chromen-4-yl)methyl-[2-(dimethylamino)-2-keto-ethyl]-methyl-ammonium Formula: C16H20ClN2O3+ MolecularWeight: 323.7946

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)C[NH+](C)CC(=O)N(C)C)Cl

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)C[NH+](C)CC(=O)N(C)C)Cl

InChI

InChI=1S/C16H19ClN2O3/c1-10-5-14-12(7-13(10)17)11(6-16(21)22-14)8-19(4)9-15(20)18(2)3/h5-7H,8-9H2,1-4H3/p+1