(2R)-5-bromanyl-4-chloranyl-2-(3-morpholin-4-ium-4-ylpropyliminomethyl)-1,2-dihydroindol-3-one

Systemtic Name: (2R)-5-bromanyl-4-chloranyl-2-(3-morpholin-4-ium-4-ylpropyliminomethyl)-1,2-dihydroindol-3-one Openeye Name: (2R)-5-bromo-4-chloro-2-(3-morpholin-4-ium-4-ylpropyliminomethyl)indolin-3-one CAS Name: (2R)-5-bromo-4-chloro-2-[3-(4-morpholin-4-iumyl)propyliminomethyl]-1,2-dihydroindol-3-one IUPAC Name: (2R)-5-bromo-4-chloro-2-(3-morpholin-4-ium-4-ylpropyliminomethyl)-1,2-dihydroindol-3-one Traditional Name: (2R)-5-bromo-4-chloro-2-(3-morpholin-4-ium-4-ylpropyliminomethyl)pseudoindoxyl Formula: C16H20BrClN3O2+ MolecularWeight: 401.7059

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCCN=CC2C(=O)C3=C(N2)C=CC(=C3Cl)Br

Isomeric SMILES

C1COCC[NH+]1CCCN=C[C@@H]2C(=O)C3=C(N2)C=CC(=C3Cl)Br

InChI

InChI=1S/C16H19BrClN3O2/c17-11-2-3-12-14(15(11)18)16(22)13(20-12)10-19-4-1-5-21-6-8-23-9-7-21/h2-3,10,13,20H,1,4-9H2/p+1/t13-/m1/s1