N-[(2R)-2-morpholin-4-ium-4-yl-2-thiophen-2-yl-ethyl]-9H-xanthene-9-carboxamide

Systemtic Name: N-[(2R)-2-morpholin-4-ium-4-yl-2-thiophen-2-yl-ethyl]-9H-xanthene-9-carboxamide Openeye Name: N-[(2R)-2-morpholin-4-ium-4-yl-2-(2-thienyl)ethyl]-9H-xanthene-9-carboxamide CAS Name: N-[(2R)-2-(4-morpholin-4-iumyl)-2-thiophen-2-ylethyl]-9H-xanthene-9-carboxamide IUPAC Name: N-[(2R)-2-morpholin-4-ium-4-yl-2-thiophen-2-ylethyl]-9H-xanthene-9-carboxamide Traditional Name: N-[(2R)-2-morpholin-4-ium-4-yl-2-(2-thienyl)ethyl]-9H-xanthene-9-carboxamide Formula: C24H25N2O3S+ MolecularWeight: 421.5319

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1C(CNC(=O)C2C3=CC=CC=C3OC4=CC=CC=C24)C5=CC=CS5

Isomeric SMILES

C1COCC[NH+]1[C@H](CNC(=O)C2C3=CC=CC=C3OC4=CC=CC=C24)C5=CC=CS5

InChI

InChI=1S/C24H24N2O3S/c27-24(25-16-19(22-10-5-15-30-22)26-11-13-28-14-12-26)23-17-6-1-3-8-20(17)29-21-9-4-2-7-18(21)23/h1-10,15,19,23H,11-14,16H2,(H,25,27)/p+1/t19-/m1/s1