3-[2-[(2,5-dimethoxyphenyl)methylamino]-2-oxidanylidene-ethyl]-1H-indole-2-carboxylic acid

Systemtic Name: 3-[2-[(2,5-dimethoxyphenyl)methylamino]-2-oxidanylidene-ethyl]-1H-indole-2-carboxylic acid Openeye Name: 3-[2-[(2,5-dimethoxyphenyl)methylamino]-2-oxo-ethyl]-1H-indole-2-carboxylic acid CAS Name: 3-[2-[(2,5-dimethoxyphenyl)methylamino]-2-oxoethyl]-1H-indole-2-carboxylic acid IUPAC Name: 3-[2-[(2,5-dimethoxyphenyl)methylamino]-2-oxoethyl]-1H-indole-2-carboxylic acid Traditional Name: 3-[2-[(2,5-dimethoxybenzyl)amino]-2-keto-ethyl]-1H-indole-2-carboxylic acid Formula: C20H20N2O5 MolecularWeight: 368.3832

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)CNC(=O)CC2=C(NC3=CC=CC=C32)C(=O)O

Isomeric SMILES

COC1=CC(=C(C=C1)OC)CNC(=O)CC2=C(NC3=CC=CC=C32)C(=O)O

InChI

InChI=1S/C20H20N2O5/c1-26-13-7-8-17(27-2)12(9-13)11-21-18(23)10-15-14-5-3-4-6-16(14)22-19(15)20(24)25/h3-9,22H,10-11H2,1-2H3,(H,21,23)(H,24,25)