2-(5-acetyloxy-1H-indol-3-yl)ethylazanium; 6-oxidanyl-6-oxidanylidene-hexanoate

Systemtic Name: 2-(5-acetyloxy-1H-indol-3-yl)ethylazanium; 6-oxidanyl-6-oxidanylidene-hexanoate Openeye Name: 2-(5-acetoxy-1H-indol-3-yl)ethylammonium; 6-hydroxy-6-oxo-hexanoate CAS Name: 2-(5-acetyloxy-1H-indol-3-yl)ethylammonium; 6-hydroxy-6-oxohexanoate IUPAC Name: 2-(5-acetyloxy-1H-indol-3-yl)ethylazanium; 6-hydroxy-6-oxohexanoate Traditional Name: 2-(5-acetoxy-1H-indol-3-yl)ethylammonium; 6-hydroxy-6-keto-hexanoate Formula: C18H24N2O6 MolecularWeight: 364.39296

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC2=C(C=C1)NC=C2CC[NH3+].C(CCC(=O)[O-])CC(=O)O

Isomeric SMILES

CC(=O)OC1=CC2=C(C=C1)NC=C2CC[NH3+].C(CCC(=O)[O-])CC(=O)O

InChI

InChI=1S/C12H14N2O2.C6H10O4/c1-8(15)16-10-2-3-12-11(6-10)9(4-5-13)7-14-12;7-5(8)3-1-2-4-6(9)10/h2-3,6-7,14H,4-5,13H2,1H3;1-4H2,(H,7,8)(H,9,10)