(3S)-3-(1H-indol-3-yl)-1-(morpholin-4-ium-4-ylmethyl)-3-oxidanyl-indol-2-one

Systemtic Name: (3S)-3-(1H-indol-3-yl)-1-(morpholin-4-ium-4-ylmethyl)-3-oxidanyl-indol-2-one Openeye Name: (3S)-3-hydroxy-3-(1H-indol-3-yl)-1-(morpholin-4-ium-4-ylmethyl)indolin-2-one CAS Name: (3S)-3-hydroxy-3-(1H-indol-3-yl)-1-(4-morpholin-4-iumylmethyl)-2-indolone IUPAC Name: (3S)-3-hydroxy-3-(1H-indol-3-yl)-1-(morpholin-4-ium-4-ylmethyl)indol-2-one Traditional Name: (3S)-3-hydroxy-3-(1H-indol-3-yl)-1-(morpholin-4-ium-4-ylmethyl)oxindole Formula: C21H22N3O3+ MolecularWeight: 364.41768

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CN2C3=CC=CC=C3C(C2=O)(C4=CNC5=CC=CC=C54)O

Isomeric SMILES

C1COCC[NH+]1CN2C3=CC=CC=C3[C@](C2=O)(C4=CNC5=CC=CC=C54)O

InChI

InChI=1S/C21H21N3O3/c25-20-21(26,17-13-22-18-7-3-1-5-15(17)18)16-6-2-4-8-19(16)24(20)14-23-9-11-27-12-10-23/h1-8,13,22,26H,9-12,14H2/p+1/t21-/m1/s1