dimethyl-[(1R)-1-thiophen-2-yl-2-(9H-xanthen-9-ylcarbonylamino)ethyl]azanium

Systemtic Name: dimethyl-[(1R)-1-thiophen-2-yl-2-(9H-xanthen-9-ylcarbonylamino)ethyl]azanium Openeye Name: dimethyl-[(1R)-1-(2-thienyl)-2-(9H-xanthene-9-carbonylamino)ethyl]ammonium CAS Name: dimethyl-[(1R)-2-[[oxo(9H-xanthen-9-yl)methyl]amino]-1-thiophen-2-ylethyl]ammonium IUPAC Name: dimethyl-[(1R)-1-thiophen-2-yl-2-(9H-xanthene-9-carbonylamino)ethyl]azanium Traditional Name: dimethyl-[(1R)-1-(2-thienyl)-2-(9H-xanthene-9-carbonylamino)ethyl]ammonium Formula: C22H23N2O2S+ MolecularWeight: 379.49522

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)C(CNC(=O)C1C2=CC=CC=C2OC3=CC=CC=C13)C4=CC=CS4

Isomeric SMILES

C[NH+](C)[C@H](CNC(=O)C1C2=CC=CC=C2OC3=CC=CC=C13)C4=CC=CS4

InChI

InChI=1S/C22H22N2O2S/c1-24(2)17(20-12-7-13-27-20)14-23-22(25)21-15-8-3-5-10-18(15)26-19-11-6-4-9-16(19)21/h3-13,17,21H,14H2,1-2H3,(H,23,25)/p+1/t17-/m1/s1