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

Systemtic Name: 1-methyl-3-[2-oxidanylidene-2-(oxolan-2-ylmethylamino)ethyl]indole-2-carboxylic acid Openeye Name: 1-methyl-3-[2-oxo-2-(tetrahydrofuran-2-ylmethylamino)ethyl]indole-2-carboxylic acid CAS Name: 1-methyl-3-[2-oxo-2-(2-oxolanylmethylamino)ethyl]-2-indolecarboxylic acid IUPAC Name: 1-methyl-3-[2-oxo-2-(oxolan-2-ylmethylamino)ethyl]indole-2-carboxylic acid Traditional Name: 3-[2-keto-2-(tetrahydrofurfurylamino)ethyl]-1-methyl-indole-2-carboxylic acid Formula: C17H20N2O4 MolecularWeight: 316.3517

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=C1C(=O)O)CC(=O)NCC3CCCO3

Isomeric SMILES

CN1C2=CC=CC=C2C(=C1C(=O)O)CC(=O)NCC3CCCO3

InChI

InChI=1S/C17H20N2O4/c1-19-14-7-3-2-6-12(14)13(16(19)17(21)22)9-15(20)18-10-11-5-4-8-23-11/h2-3,6-7,11H,4-5,8-10H2,1H3,(H,18,20)(H,21,22)