3-[3-(morpholin-4-ium-4-ylmethyl)indol-1-yl]propanoate

Systemtic Name: 3-[3-(morpholin-4-ium-4-ylmethyl)indol-1-yl]propanoate Openeye Name: 3-[3-(morpholin-4-ium-4-ylmethyl)indol-1-yl]propanoate CAS Name: 3-[3-(4-morpholin-4-iumylmethyl)-1-indolyl]propanoate IUPAC Name: 3-[3-(morpholin-4-ium-4-ylmethyl)indol-1-yl]propanoate Traditional Name: 3-[3-(morpholin-4-ium-4-ylmethyl)indol-1-yl]propionate Formula: C16H20N2O3 MolecularWeight: 288.3416

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC2=CN(C3=CC=CC=C32)CCC(=O)[O-]

Isomeric SMILES

C1COCC[NH+]1CC2=CN(C3=CC=CC=C32)CCC(=O)[O-]

InChI

InChI=1S/C16H20N2O3/c19-16(20)5-6-18-12-13(11-17-7-9-21-10-8-17)14-3-1-2-4-15(14)18/h1-4,12H,5-11H2,(H,19,20)