(3S)-3-[2-(4-tert-butylphenyl)-2-oxidanylidene-ethyl]-1-(morpholin-4-ium-4-ylmethyl)-3-oxidanyl-indol-2-one

Systemtic Name: (3S)-3-[2-(4-tert-butylphenyl)-2-oxidanylidene-ethyl]-1-(morpholin-4-ium-4-ylmethyl)-3-oxidanyl-indol-2-one Openeye Name: (3S)-3-[2-(4-tert-butylphenyl)-2-oxo-ethyl]-3-hydroxy-1-(morpholin-4-ium-4-ylmethyl)indolin-2-one CAS Name: (3S)-3-[2-(4-tert-butylphenyl)-2-oxoethyl]-3-hydroxy-1-(4-morpholin-4-iumylmethyl)-2-indolone IUPAC Name: (3S)-3-[2-(4-tert-butylphenyl)-2-oxoethyl]-3-hydroxy-1-(morpholin-4-ium-4-ylmethyl)indol-2-one Traditional Name: (3S)-3-[2-(4-tert-butylphenyl)-2-keto-ethyl]-3-hydroxy-1-(morpholin-4-ium-4-ylmethyl)oxindole Formula: C25H31N2O4+ MolecularWeight: 423.52464

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)CC2(C3=CC=CC=C3N(C2=O)C[NH+]4CCOCC4)O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)C[C@@]2(C3=CC=CC=C3N(C2=O)C[NH+]4CCOCC4)O

InChI

InChI=1S/C25H30N2O4/c1-24(2,3)19-10-8-18(9-11-19)22(28)16-25(30)20-6-4-5-7-21(20)27(23(25)29)17-26-12-14-31-15-13-26/h4-11,30H,12-17H2,1-3H3/p+1/t25-/m0/s1