1-ethyl-3-[2-oxidanylidene-2-(oxolan-2-ylmethylamino)ethyl]indole-2-carboxylic acid

Systemtic Name: 1-ethyl-3-[2-oxidanylidene-2-(oxolan-2-ylmethylamino)ethyl]indole-2-carboxylic acid Openeye Name: 1-ethyl-3-[2-oxo-2-(tetrahydrofuran-2-ylmethylamino)ethyl]indole-2-carboxylic acid CAS Name: 1-ethyl-3-[2-oxo-2-(2-oxolanylmethylamino)ethyl]-2-indolecarboxylic acid IUPAC Name: 1-ethyl-3-[2-oxo-2-(oxolan-2-ylmethylamino)ethyl]indole-2-carboxylic acid Traditional Name: 1-ethyl-3-[2-keto-2-(tetrahydrofurfurylamino)ethyl]indole-2-carboxylic acid Formula: C18H22N2O4 MolecularWeight: 330.37828

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2C(=C1C(=O)O)CC(=O)NCC3CCCO3

Isomeric SMILES

CCN1C2=CC=CC=C2C(=C1C(=O)O)CC(=O)NCC3CCCO3

InChI

InChI=1S/C18H22N2O4/c1-2-20-15-8-4-3-7-13(15)14(17(20)18(22)23)10-16(21)19-11-12-6-5-9-24-12/h3-4,7-8,12H,2,5-6,9-11H2,1H3,(H,19,21)(H,22,23)