[(1S)-1-(2-chlorophenyl)-2-(9H-xanthen-9-ylcarbonylamino)ethyl]-diethyl-azanium

Systemtic Name: [(1S)-1-(2-chlorophenyl)-2-(9H-xanthen-9-ylcarbonylamino)ethyl]-diethyl-azanium Openeye Name: [(1S)-1-(2-chlorophenyl)-2-(9H-xanthene-9-carbonylamino)ethyl]-diethyl-ammonium CAS Name: [(1S)-1-(2-chlorophenyl)-2-[[oxo(9H-xanthen-9-yl)methyl]amino]ethyl]-diethylammonium IUPAC Name: [(1S)-1-(2-chlorophenyl)-2-(9H-xanthene-9-carbonylamino)ethyl]-diethylazanium Traditional Name: [(1S)-1-(2-chlorophenyl)-2-(9H-xanthene-9-carbonylamino)ethyl]-diethyl-ammonium Formula: C26H28ClN2O2+ MolecularWeight: 435.96572

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)C(CNC(=O)C1C2=CC=CC=C2OC3=CC=CC=C13)C4=CC=CC=C4Cl

Isomeric SMILES

CC[NH+](CC)[C@H](CNC(=O)C1C2=CC=CC=C2OC3=CC=CC=C13)C4=CC=CC=C4Cl

InChI

InChI=1S/C26H27ClN2O2/c1-3-29(4-2)22(18-11-5-8-14-21(18)27)17-28-26(30)25-19-12-6-9-15-23(19)31-24-16-10-7-13-20(24)25/h5-16,22,25H,3-4,17H2,1-2H3,(H,28,30)/p+1/t22-/m1/s1