2-hydroxyethyl-[(4-methyl-3-oxidanyl-6-oxidanylidene-benzo[c]chromen-2-yl)methyl]azanium chloride

Systemtic Name: 2-hydroxyethyl-[(4-methyl-3-oxidanyl-6-oxidanylidene-benzo[c]chromen-2-yl)methyl]azanium chloride Openeye Name: 2-hydroxyethyl-[(3-hydroxy-4-methyl-6-oxo-benzo[c]chromen-2-yl)methyl]ammonium chloride CAS Name: 2-hydroxyethyl-[(3-hydroxy-4-methyl-6-oxo-2-benzo[c][1]benzopyranyl)methyl]ammonium chloride IUPAC Name: 2-hydroxyethyl-[(3-hydroxy-4-methyl-6-oxobenzo[c]chromen-2-yl)methyl]azanium chloride Traditional Name: 2-hydroxyethyl-[(3-hydroxy-6-keto-4-methyl-benzo[c]chromen-2-yl)methyl]ammonium chloride Formula: C17H18ClNO4 MolecularWeight: 335.78212

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1O)C[NH2+]CCO)C3=CC=CC=C3C(=O)O2.[Cl-]

Isomeric SMILES

CC1=C2C(=CC(=C1O)C[NH2+]CCO)C3=CC=CC=C3C(=O)O2.[Cl-]

InChI

InChI=1S/C17H17NO4.ClH/c1-10-15(20)11(9-18-6-7-19)8-14-12-4-2-3-5-13(12)17(21)22-16(10)14;/h2-5,8,18-20H,6-7,9H2,1H3;1H