(3-oxidanylidenebenzo[f]chromen-1-yl)methyl-(2-pyrrolidin-1-ium-1-ylethyl)azanium

Systemtic Name: (3-oxidanylidenebenzo[f]chromen-1-yl)methyl-(2-pyrrolidin-1-ium-1-ylethyl)azanium Openeye Name: (3-oxobenzo[f]chromen-1-yl)methyl-(2-pyrrolidin-1-ium-1-ylethyl)ammonium CAS Name: (3-oxo-1-benzo[f][1]benzopyranyl)methyl-[2-(1-pyrrolidin-1-iumyl)ethyl]ammonium IUPAC Name: (3-oxobenzo[f]chromen-1-yl)methyl-(2-pyrrolidin-1-ium-1-ylethyl)azanium Traditional Name: (3-ketobenzo[f]chromen-1-yl)methyl-(2-pyrrolidin-1-ium-1-ylethyl)ammonium Formula: C20H24N2O2+2 MolecularWeight: 324.41676

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CC[NH2+]CC2=CC(=O)OC3=C2C4=CC=CC=C4C=C3

Isomeric SMILES

C1CC[NH+](C1)CC[NH2+]CC2=CC(=O)OC3=C2C4=CC=CC=C4C=C3

InChI

InChI=1S/C20H22N2O2/c23-19-13-16(14-21-9-12-22-10-3-4-11-22)20-17-6-2-1-5-15(17)7-8-18(20)24-19/h1-2,5-8,13,21H,3-4,9-12,14H2/p+2