[6-chloranyl-4-methyl-7-oxidanyl-2-oxidanylidene-3-(phenylmethyl)chromen-8-yl]methyl-diethyl-azanium

Systemtic Name: [6-chloranyl-4-methyl-7-oxidanyl-2-oxidanylidene-3-(phenylmethyl)chromen-8-yl]methyl-diethyl-azanium Openeye Name: (3-benzyl-6-chloro-7-hydroxy-4-methyl-2-oxo-chromen-8-yl)methyl-diethyl-ammonium CAS Name: [6-chloro-7-hydroxy-4-methyl-2-oxo-3-(phenylmethyl)-1-benzopyran-8-yl]methyl-diethylammonium IUPAC Name: (3-benzyl-6-chloro-7-hydroxy-4-methyl-2-oxochromen-8-yl)methyl-diethylazanium Traditional Name: (3-benzyl-6-chloro-7-hydroxy-2-keto-4-methyl-chromen-8-yl)methyl-diethyl-ammonium Formula: C22H25ClNO3+ MolecularWeight: 386.8918

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC1=C2C(=CC(=C1O)Cl)C(=C(C(=O)O2)CC3=CC=CC=C3)C

Isomeric SMILES

CC[NH+](CC)CC1=C2C(=CC(=C1O)Cl)C(=C(C(=O)O2)CC3=CC=CC=C3)C

InChI

InChI=1S/C22H24ClNO3/c1-4-24(5-2)13-18-20(25)19(23)12-16-14(3)17(22(26)27-21(16)18)11-15-9-7-6-8-10-15/h6-10,12,25H,4-5,11,13H2,1-3H3/p+1