5-ethyl-1-(2-piperidin-1-ium-1-ylethyl)indole-2,3-dione

Systemtic Name: 5-ethyl-1-(2-piperidin-1-ium-1-ylethyl)indole-2,3-dione Openeye Name: 5-ethyl-1-(2-piperidin-1-ium-1-ylethyl)indoline-2,3-dione CAS Name: 5-ethyl-1-[2-(1-piperidin-1-iumyl)ethyl]indole-2,3-dione IUPAC Name: 5-ethyl-1-(2-piperidin-1-ium-1-ylethyl)indole-2,3-dione Traditional Name: 5-ethyl-1-(2-piperidin-1-ium-1-ylethyl)isatin Formula: C17H23N2O2+ MolecularWeight: 287.37672

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)N(C(=O)C2=O)CC[NH+]3CCCCC3

Isomeric SMILES

CCC1=CC2=C(C=C1)N(C(=O)C2=O)CC[NH+]3CCCCC3

InChI

InChI=1S/C17H22N2O2/c1-2-13-6-7-15-14(12-13)16(20)17(21)19(15)11-10-18-8-4-3-5-9-18/h6-7,12H,2-5,8-11H2,1H3/p+1