(3-oxidanylidenebenzo[f]chromen-1-yl)methyl-[(3R)-1-(phenylmethyl)pyrrolidin-1-ium-3-yl]azanium

Systemtic Name: (3-oxidanylidenebenzo[f]chromen-1-yl)methyl-[(3R)-1-(phenylmethyl)pyrrolidin-1-ium-3-yl]azanium Openeye Name: [(3R)-1-benzylpyrrolidin-1-ium-3-yl]-[(3-oxobenzo[f]chromen-1-yl)methyl]ammonium CAS Name: (3-oxo-1-benzo[f][1]benzopyranyl)methyl-[(3R)-1-(phenylmethyl)-3-pyrrolidin-1-iumyl]ammonium IUPAC Name: [(3R)-1-benzylpyrrolidin-1-ium-3-yl]-[(3-oxobenzo[f]chromen-1-yl)methyl]azanium Traditional Name: [(3R)-1-benzylpyrrolidin-1-ium-3-yl]-[(3-ketobenzo[f]chromen-1-yl)methyl]ammonium Formula: C25H26N2O2+2 MolecularWeight: 386.48614

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC1[NH2+]CC2=CC(=O)OC3=C2C4=CC=CC=C4C=C3)CC5=CC=CC=C5

Isomeric SMILES

C1C[NH+](C[C@@H]1[NH2+]CC2=CC(=O)OC3=C2C4=CC=CC=C4C=C3)CC5=CC=CC=C5

InChI

InChI=1S/C25H24N2O2/c28-24-14-20(25-22-9-5-4-8-19(22)10-11-23(25)29-24)15-26-21-12-13-27(17-21)16-18-6-2-1-3-7-18/h1-11,14,21,26H,12-13,15-17H2/p+2/t21-/m1/s1