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

Systemtic Name: (4-methyl-3-oxidanyl-6-oxidanylidene-benzo[c]chromen-2-yl)methyl-(3-oxidanylpropyl)azanium Openeye Name: (3-hydroxy-4-methyl-6-oxo-benzo[c]chromen-2-yl)methyl-(3-hydroxypropyl)ammonium CAS Name: (3-hydroxy-4-methyl-6-oxo-2-benzo[c][1]benzopyranyl)methyl-(3-hydroxypropyl)ammonium IUPAC Name: (3-hydroxy-4-methyl-6-oxobenzo[c]chromen-2-yl)methyl-(3-hydroxypropyl)azanium Traditional Name: (3-hydroxy-6-keto-4-methyl-benzo[c]chromen-2-yl)methyl-(3-hydroxypropyl)ammonium Formula: C18H20NO4+ MolecularWeight: 314.3557

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19NO4/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/p+1