2-(2-methoxy-5-methyl-phenyl)ethyl-[(7-methoxy-2-oxidanylidene-chromen-4-yl)methyl]azanium

Systemtic Name: 2-(2-methoxy-5-methyl-phenyl)ethyl-[(7-methoxy-2-oxidanylidene-chromen-4-yl)methyl]azanium Openeye Name: 2-(2-methoxy-5-methyl-phenyl)ethyl-[(7-methoxy-2-oxo-chromen-4-yl)methyl]ammonium CAS Name: 2-(2-methoxy-5-methylphenyl)ethyl-[(7-methoxy-2-oxo-1-benzopyran-4-yl)methyl]ammonium IUPAC Name: 2-(2-methoxy-5-methylphenyl)ethyl-[(7-methoxy-2-oxochromen-4-yl)methyl]azanium Traditional Name: (2-keto-7-methoxy-chromen-4-yl)methyl-[2-(2-methoxy-5-methyl-phenyl)ethyl]ammonium Formula: C21H24NO4+ MolecularWeight: 354.41956

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)CC[NH2+]CC2=CC(=O)OC3=C2C=CC(=C3)OC

Isomeric SMILES

CC1=CC(=C(C=C1)OC)CC[NH2+]CC2=CC(=O)OC3=C2C=CC(=C3)OC

InChI

InChI=1S/C21H23NO4/c1-14-4-7-19(25-3)15(10-14)8-9-22-13-16-11-21(23)26-20-12-17(24-2)5-6-18(16)20/h4-7,10-12,22H,8-9,13H2,1-3H3/p+1