(5-bromanyl-2-oxidanylidene-1H-indol-3-ylidene)-[(S)-diethoxyphosphoryl(phenyl)methyl]azanium

Systemtic Name: (5-bromanyl-2-oxidanylidene-1H-indol-3-ylidene)-[(S)-diethoxyphosphoryl(phenyl)methyl]azanium Openeye Name: (5-bromo-2-oxo-indolin-3-ylidene)-[(S)-diethoxyphosphoryl(phenyl)methyl]ammonium CAS Name: (5-bromo-2-oxo-1H-indol-3-ylidene)-[(S)-diethoxyphosphoryl(phenyl)methyl]ammonium IUPAC Name: (5-bromo-2-oxo-1H-indol-3-ylidene)-[(S)-diethoxyphosphoryl(phenyl)methyl]azanium Traditional Name: (5-bromo-2-keto-indolin-3-ylidene)-[(S)-diethoxyphosphoryl(phenyl)methyl]ammonium Formula: C19H21BrN2O4P+ MolecularWeight: 452.258801

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C(C1=CC=CC=C1)[NH+]=C2C3=C(C=CC(=C3)Br)NC2=O)OCC

Isomeric SMILES

CCOP(=O)([C@@H](C1=CC=CC=C1)[NH+]=C2C3=C(C=CC(=C3)Br)NC2=O)OCC

InChI

InChI=1S/C19H20BrN2O4P/c1-3-25-27(24,26-4-2)19(13-8-6-5-7-9-13)22-17-15-12-14(20)10-11-16(15)21-18(17)23/h5-12,19H,3-4H2,1-2H3,(H,21,22,23)/p+1/t19-/m0/s1