2-[5-(phenylcarbonyloxy)-1H-indol-3-yl]ethylazanium ethanoate

Systemtic Name: 2-[5-(phenylcarbonyloxy)-1H-indol-3-yl]ethylazanium ethanoate Openeye Name: 2-(5-benzoyloxy-1H-indol-3-yl)ethylammonium acetate CAS Name: 2-(5-benzoyloxy-1H-indol-3-yl)ethylammonium acetate IUPAC Name: 2-(5-benzoyloxy-1H-indol-3-yl)ethylazanium acetate Traditional Name: 2-(5-benzoyloxy-1H-indol-3-yl)ethylammonium acetate Formula: C19H20N2O4 MolecularWeight: 340.3731

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)[O-].C1=CC=C(C=C1)C(=O)OC2=CC3=C(C=C2)NC=C3CC[NH3+]

Isomeric SMILES

CC(=O)[O-].C1=CC=C(C=C1)C(=O)OC2=CC3=C(C=C2)NC=C3CC[NH3+]

InChI

InChI=1S/C17H16N2O2.C2H4O2/c18-9-8-13-11-19-16-7-6-14(10-15(13)16)21-17(20)12-4-2-1-3-5-12;1-2(3)4/h1-7,10-11,19H,8-9,18H2;1H3,(H,3,4)