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

Systemtic Name: (3S)-1-(morpholin-4-ium-4-ylmethyl)-3-oxidanyl-3-(2-oxidanylidenepropyl)indol-2-one Openeye Name: (3S)-3-acetonyl-3-hydroxy-1-(morpholin-4-ium-4-ylmethyl)indolin-2-one CAS Name: (3S)-3-hydroxy-1-(4-morpholin-4-iumylmethyl)-3-(2-oxopropyl)-2-indolone IUPAC Name: (3S)-3-hydroxy-1-(morpholin-4-ium-4-ylmethyl)-3-(2-oxopropyl)indol-2-one Traditional Name: (3S)-3-acetonyl-3-hydroxy-1-(morpholin-4-ium-4-ylmethyl)oxindole Formula: C16H21N2O4+ MolecularWeight: 305.34894

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC1(C2=CC=CC=C2N(C1=O)C[NH+]3CCOCC3)O

Isomeric SMILES

CC(=O)C[C@@]1(C2=CC=CC=C2N(C1=O)C[NH+]3CCOCC3)O

InChI

InChI=1S/C16H20N2O4/c1-12(19)10-16(21)13-4-2-3-5-14(13)18(15(16)20)11-17-6-8-22-9-7-17/h2-5,21H,6-11H2,1H3/p+1/t16-/m0/s1