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

Systemtic Name: (4-methyl-3-oxidanyl-6-oxidanylidene-benzo[c]chromen-2-yl)methyl-(3-oxidanylpropyl)azanium chloride Openeye Name: (3-hydroxy-4-methyl-6-oxo-benzo[c]chromen-2-yl)methyl-(3-hydroxypropyl)ammonium chloride CAS Name: (3-hydroxy-4-methyl-6-oxo-2-benzo[c][1]benzopyranyl)methyl-(3-hydroxypropyl)ammonium chloride IUPAC Name: (3-hydroxy-4-methyl-6-oxobenzo[c]chromen-2-yl)methyl-(3-hydroxypropyl)azanium chloride Traditional Name: (3-hydroxy-6-keto-4-methyl-benzo[c]chromen-2-yl)methyl-(3-hydroxypropyl)ammonium chloride Formula: C18H20ClNO4 MolecularWeight: 349.8087

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19NO4.ClH/c1-11-16(21)12(10-19-7-4-8-20)9-15-13-5-2-3-6-14(13)18(22)23-17(11)15;/h2-3,5-6,9,19-21H,4,7-8,10H2,1H3;1H