1-methyl-3-[2-oxidanylidene-2-[(3,4,5-trimethoxyphenyl)amino]ethyl]indole-2-carboxylate

Systemtic Name: 1-methyl-3-[2-oxidanylidene-2-[(3,4,5-trimethoxyphenyl)amino]ethyl]indole-2-carboxylate Openeye Name: 1-methyl-3-[2-oxo-2-(3,4,5-trimethoxyanilino)ethyl]indole-2-carboxylate CAS Name: 1-methyl-3-[2-oxo-2-(3,4,5-trimethoxyanilino)ethyl]-2-indolecarboxylate IUPAC Name: 1-methyl-3-[2-oxo-2-(3,4,5-trimethoxyanilino)ethyl]indole-2-carboxylate Traditional Name: 3-[2-keto-2-(3,4,5-trimethoxyanilino)ethyl]-1-methyl-indole-2-carboxylate Formula: C21H21N2O6- MolecularWeight: 397.40124

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=C1C(=O)[O-])CC(=O)NC3=CC(=C(C(=C3)OC)OC)OC

Isomeric SMILES

CN1C2=CC=CC=C2C(=C1C(=O)[O-])CC(=O)NC3=CC(=C(C(=C3)OC)OC)OC

InChI

InChI=1S/C21H22N2O6/c1-23-15-8-6-5-7-13(15)14(19(23)21(25)26)11-18(24)22-12-9-16(27-2)20(29-4)17(10-12)28-3/h5-10H,11H2,1-4H3,(H,22,24)(H,25,26)/p-1