4-oxidanylidene-4-[1-(2-pyrrolidin-1-ium-1-ylethyl)-2,3-dihydroindol-5-yl]butanoate

Systemtic Name: 4-oxidanylidene-4-[1-(2-pyrrolidin-1-ium-1-ylethyl)-2,3-dihydroindol-5-yl]butanoate Openeye Name: 4-oxo-4-[1-(2-pyrrolidin-1-ium-1-ylethyl)indolin-5-yl]butanoate CAS Name: 4-oxo-4-[1-[2-(1-pyrrolidin-1-iumyl)ethyl]-2,3-dihydroindol-5-yl]butanoate IUPAC Name: 4-oxo-4-[1-(2-pyrrolidin-1-ium-1-ylethyl)-2,3-dihydroindol-5-yl]butanoate Traditional Name: 4-keto-4-[1-(2-pyrrolidin-1-ium-1-ylethyl)indolin-5-yl]butyrate Formula: C18H24N2O3 MolecularWeight: 316.39476

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CCN2CCC3=C2C=CC(=C3)C(=O)CCC(=O)[O-]

Isomeric SMILES

C1CC[NH+](C1)CCN2CCC3=C2C=CC(=C3)C(=O)CCC(=O)[O-]

InChI

InChI=1S/C18H24N2O3/c21-17(5-6-18(22)23)15-3-4-16-14(13-15)7-10-20(16)12-11-19-8-1-2-9-19/h3-4,13H,1-2,5-12H2,(H,22,23)