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

Systemtic Name: (3S)-1-[(4-methylpiperazin-4-ium-1-yl)methyl]-3-oxidanyl-3-(2-oxidanylidene-2-pyridin-2-yl-ethyl)indol-2-one Openeye Name: (3S)-3-hydroxy-1-[(4-methylpiperazin-4-ium-1-yl)methyl]-3-[2-oxo-2-(2-pyridyl)ethyl]indolin-2-one CAS Name: (3S)-3-hydroxy-1-[(4-methyl-1-piperazin-4-iumyl)methyl]-3-[2-oxo-2-(2-pyridinyl)ethyl]-2-indolone IUPAC Name: (3S)-3-hydroxy-1-[(4-methylpiperazin-4-ium-1-yl)methyl]-3-(2-oxo-2-pyridin-2-ylethyl)indol-2-one Traditional Name: (3S)-3-hydroxy-3-[2-keto-2-(2-pyridyl)ethyl]-1-[(4-methylpiperazin-4-ium-1-yl)methyl]oxindole Formula: C21H25N4O3+ MolecularWeight: 381.4482

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)CN2C3=CC=CC=C3C(C2=O)(CC(=O)C4=CC=CC=N4)O

Isomeric SMILES

C[NH+]1CCN(CC1)CN2C3=CC=CC=C3[C@](C2=O)(CC(=O)C4=CC=CC=N4)O

InChI

InChI=1S/C21H24N4O3/c1-23-10-12-24(13-11-23)15-25-18-8-3-2-6-16(18)21(28,20(25)27)14-19(26)17-7-4-5-9-22-17/h2-9,28H,10-15H2,1H3/p+1/t21-/m0/s1