4-[1-[3-(dimethylazaniumyl)propyl]-2,3-dihydroindol-5-yl]-4-oxidanylidene-butanoate

Systemtic Name: 4-[1-[3-(dimethylazaniumyl)propyl]-2,3-dihydroindol-5-yl]-4-oxidanylidene-butanoate Openeye Name: 4-[1-[3-(dimethylammonio)propyl]indolin-5-yl]-4-oxo-butanoate CAS Name: 4-[1-[3-(dimethylammonio)propyl]-2,3-dihydroindol-5-yl]-4-oxobutanoate IUPAC Name: 4-[1-[3-(dimethylazaniumyl)propyl]-2,3-dihydroindol-5-yl]-4-oxobutanoate Traditional Name: 4-[1-[3-(dimethylammonio)propyl]indolin-5-yl]-4-keto-butyrate Formula: C17H24N2O3 MolecularWeight: 304.38406

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCN1CCC2=C1C=CC(=C2)C(=O)CCC(=O)[O-]

Isomeric SMILES

C[NH+](C)CCCN1CCC2=C1C=CC(=C2)C(=O)CCC(=O)[O-]

InChI

InChI=1S/C17H24N2O3/c1-18(2)9-3-10-19-11-8-13-12-14(4-5-15(13)19)16(20)6-7-17(21)22/h4-5,12H,3,6-11H2,1-2H3,(H,21,22)