4-(1-hexyl-2,3-dihydroindol-5-yl)-4-oxidanylidene-butanoate

Systemtic Name: 4-(1-hexyl-2,3-dihydroindol-5-yl)-4-oxidanylidene-butanoate Openeye Name: 4-(1-hexylindolin-5-yl)-4-oxo-butanoate CAS Name: 4-(1-hexyl-2,3-dihydroindol-5-yl)-4-oxobutanoate IUPAC Name: 4-(1-hexyl-2,3-dihydroindol-5-yl)-4-oxobutanoate Traditional Name: 4-(1-hexylindolin-5-yl)-4-keto-butyrate Formula: C18H24NO3- MolecularWeight: 302.38806

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1CCC2=C1C=CC(=C2)C(=O)CCC(=O)[O-]

Isomeric SMILES

CCCCCCN1CCC2=C1C=CC(=C2)C(=O)CCC(=O)[O-]

InChI

InChI=1S/C18H25NO3/c1-2-3-4-5-11-19-12-10-14-13-15(6-7-16(14)19)17(20)8-9-18(21)22/h6-7,13H,2-5,8-12H2,1H3,(H,21,22)/p-1