6-chloranyl-2-oxidanylidene-8-[[3-(2-oxidanylidenepyrrolidin-1-yl)propylazaniumyl]methyl]-4-phenyl-chromen-7-olate

Systemtic Name: 6-chloranyl-2-oxidanylidene-8-[[3-(2-oxidanylidenepyrrolidin-1-yl)propylazaniumyl]methyl]-4-phenyl-chromen-7-olate Openeye Name: 6-chloro-2-oxo-8-[[3-(2-oxopyrrolidin-1-yl)propylammonio]methyl]-4-phenyl-chromen-7-olate CAS Name: 6-chloro-2-oxo-8-[[3-(2-oxo-1-pyrrolidinyl)propylammonio]methyl]-4-phenyl-1-benzopyran-7-olate IUPAC Name: 6-chloro-2-oxo-8-[[3-(2-oxopyrrolidin-1-yl)propylazaniumyl]methyl]-4-phenylchromen-7-olate Traditional Name: 6-chloro-2-keto-8-[[3-(2-ketopyrrolidino)propylammonio]methyl]-4-phenyl-chromen-7-olate Formula: C23H23ClN2O4 MolecularWeight: 426.89272

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)CCC[NH2+]CC2=C3C(=CC(=C2[O-])Cl)C(=CC(=O)O3)C4=CC=CC=C4

Isomeric SMILES

C1CC(=O)N(C1)CCC[NH2+]CC2=C3C(=CC(=C2[O-])Cl)C(=CC(=O)O3)C4=CC=CC=C4

InChI

InChI=1S/C23H23ClN2O4/c24-19-12-17-16(15-6-2-1-3-7-15)13-21(28)30-23(17)18(22(19)29)14-25-9-5-11-26-10-4-8-20(26)27/h1-3,6-7,12-13,25,29H,4-5,8-11,14H2