(6-chloranyl-7-methyl-2-oxidanylidene-chromen-4-yl)methyl-[(3,4-dimethoxyphenyl)methyl]-methyl-azanium

Systemtic Name: (6-chloranyl-7-methyl-2-oxidanylidene-chromen-4-yl)methyl-[(3,4-dimethoxyphenyl)methyl]-methyl-azanium Openeye Name: (6-chloro-7-methyl-2-oxo-chromen-4-yl)methyl-[(3,4-dimethoxyphenyl)methyl]-methyl-ammonium CAS Name: (6-chloro-7-methyl-2-oxo-1-benzopyran-4-yl)methyl-[(3,4-dimethoxyphenyl)methyl]-methylammonium IUPAC Name: (6-chloro-7-methyl-2-oxochromen-4-yl)methyl-[(3,4-dimethoxyphenyl)methyl]-methylazanium Traditional Name: (6-chloro-2-keto-7-methyl-chromen-4-yl)methyl-methyl-veratryl-ammonium Formula: C21H23ClNO4+ MolecularWeight: 388.86462

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)C[NH+](C)CC3=CC(=C(C=C3)OC)OC)Cl

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)C[NH+](C)CC3=CC(=C(C=C3)OC)OC)Cl

InChI

InChI=1S/C21H22ClNO4/c1-13-7-19-16(10-17(13)22)15(9-21(24)27-19)12-23(2)11-14-5-6-18(25-3)20(8-14)26-4/h5-10H,11-12H2,1-4H3/p+1