4-ethyl-2-[2-(5-methoxy-2-methyl-1H-indol-3-yl)ethanoylamino]benzoic acid

Systemtic Name: 4-ethyl-2-[2-(5-methoxy-2-methyl-1H-indol-3-yl)ethanoylamino]benzoic acid Openeye Name: 4-ethyl-2-[[2-(5-methoxy-2-methyl-1H-indol-3-yl)acetyl]amino]benzoic acid CAS Name: 4-ethyl-2-[[2-(5-methoxy-2-methyl-1H-indol-3-yl)-1-oxoethyl]amino]benzoic acid IUPAC Name: 4-ethyl-2-[[2-(5-methoxy-2-methyl-1H-indol-3-yl)acetyl]amino]benzoic acid Traditional Name: 4-ethyl-2-[[2-(5-methoxy-2-methyl-1H-indol-3-yl)acetyl]amino]benzoic acid Formula: C21H22N2O4 MolecularWeight: 366.41038

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)C(=O)O)NC(=O)CC2=C(NC3=C2C=C(C=C3)OC)C

Isomeric SMILES

CCC1=CC(=C(C=C1)C(=O)O)NC(=O)CC2=C(NC3=C2C=C(C=C3)OC)C

InChI

InChI=1S/C21H22N2O4/c1-4-13-5-7-15(21(25)26)19(9-13)23-20(24)11-16-12(2)22-18-8-6-14(27-3)10-17(16)18/h5-10,22H,4,11H2,1-3H3,(H,23,24)(H,25,26)