(3S)-3-[2-(4-ethylphenyl)-2-oxidanylidene-ethyl]-1-[(4-ethylpiperazin-4-ium-1-yl)methyl]-3-oxidanyl-indol-2-one

Systemtic Name: (3S)-3-[2-(4-ethylphenyl)-2-oxidanylidene-ethyl]-1-[(4-ethylpiperazin-4-ium-1-yl)methyl]-3-oxidanyl-indol-2-one Openeye Name: (3S)-3-[2-(4-ethylphenyl)-2-oxo-ethyl]-1-[(4-ethylpiperazin-4-ium-1-yl)methyl]-3-hydroxy-indolin-2-one CAS Name: (3S)-3-[2-(4-ethylphenyl)-2-oxoethyl]-1-[(4-ethyl-1-piperazin-4-iumyl)methyl]-3-hydroxy-2-indolone IUPAC Name: (3S)-3-[2-(4-ethylphenyl)-2-oxoethyl]-1-[(4-ethylpiperazin-4-ium-1-yl)methyl]-3-hydroxyindol-2-one Traditional Name: (3S)-3-[2-(4-ethylphenyl)-2-keto-ethyl]-1-[(4-ethylpiperazin-4-ium-1-yl)methyl]-3-hydroxy-oxindole Formula: C25H32N3O3+ MolecularWeight: 422.53988

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)CC2(C3=CC=CC=C3N(C2=O)CN4CC[NH+](CC4)CC)O

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)C[C@@]2(C3=CC=CC=C3N(C2=O)CN4CC[NH+](CC4)CC)O

InChI

InChI=1S/C25H31N3O3/c1-3-19-9-11-20(12-10-19)23(29)17-25(31)21-7-5-6-8-22(21)28(24(25)30)18-27-15-13-26(4-2)14-16-27/h5-12,31H,3-4,13-18H2,1-2H3/p+1/t25-/m0/s1