(8-chloranyl-7-oxidanyl-4-oxidanylidene-2,3-dihydro-1H-cyclopenta[c]chromen-6-yl)methyl-(2-methoxyethyl)azanium

Systemtic Name: (8-chloranyl-7-oxidanyl-4-oxidanylidene-2,3-dihydro-1H-cyclopenta[c]chromen-6-yl)methyl-(2-methoxyethyl)azanium Openeye Name: (8-chloro-7-hydroxy-4-oxo-2,3-dihydro-1H-cyclopenta[c]chromen-6-yl)methyl-(2-methoxyethyl)ammonium CAS Name: (8-chloro-7-hydroxy-4-oxo-2,3-dihydro-1H-cyclopenta[c][1]benzopyran-6-yl)methyl-(2-methoxyethyl)ammonium IUPAC Name: (8-chloro-7-hydroxy-4-oxo-2,3-dihydro-1H-cyclopenta[c]chromen-6-yl)methyl-(2-methoxyethyl)azanium Traditional Name: (8-chloro-7-hydroxy-4-keto-2,3-dihydro-1H-cyclopenta[c]chromen-6-yl)methyl-(2-methoxyethyl)ammonium Formula: C16H19ClNO4+ MolecularWeight: 324.77936

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCC[NH2+]CC1=C2C(=CC(=C1O)Cl)C3=C(CCC3)C(=O)O2

Isomeric SMILES

COCC[NH2+]CC1=C2C(=CC(=C1O)Cl)C3=C(CCC3)C(=O)O2

InChI

InChI=1S/C16H18ClNO4/c1-21-6-5-18-8-12-14(19)13(17)7-11-9-3-2-4-10(9)16(20)22-15(11)12/h7,18-19H,2-6,8H2,1H3/p+1