2-dimethylaminoethyl-[(3-ethanoyl-7-oxidanyl-2-oxidanylidene-chromen-5-yl)methyl]azanium

Systemtic Name: 2-dimethylaminoethyl-[(3-ethanoyl-7-oxidanyl-2-oxidanylidene-chromen-5-yl)methyl]azanium Openeye Name: (3-acetyl-7-hydroxy-2-oxo-chromen-5-yl)methyl-(2-dimethylaminoethyl)ammonium CAS Name: (3-acetyl-7-hydroxy-2-oxo-1-benzopyran-5-yl)methyl-(2-dimethylaminoethyl)ammonium IUPAC Name: (3-acetyl-7-hydroxy-2-oxochromen-5-yl)methyl-(2-dimethylaminoethyl)azanium Traditional Name: (3-acetyl-7-hydroxy-2-keto-chromen-5-yl)methyl-(2-dimethylaminoethyl)ammonium Formula: C16H21N2O4+ MolecularWeight: 305.34894

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(C=C(C=C2C[NH2+]CCN(C)C)O)OC1=O

Isomeric SMILES

CC(=O)C1=CC2=C(C=C(C=C2C[NH2+]CCN(C)C)O)OC1=O

InChI

InChI=1S/C16H20N2O4/c1-10(19)13-8-14-11(9-17-4-5-18(2)3)6-12(20)7-15(14)22-16(13)21/h6-8,17,20H,4-5,9H2,1-3H3/p+1