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

Systemtic Name: 4-bromanyl-2-[2-(5-methoxy-2-methyl-1H-indol-3-yl)ethanoylamino]benzoic acid Openeye Name: 4-bromo-2-[[2-(5-methoxy-2-methyl-1H-indol-3-yl)acetyl]amino]benzoic acid CAS Name: 4-bromo-2-[[2-(5-methoxy-2-methyl-1H-indol-3-yl)-1-oxoethyl]amino]benzoic acid IUPAC Name: 4-bromo-2-[[2-(5-methoxy-2-methyl-1H-indol-3-yl)acetyl]amino]benzoic acid Traditional Name: 4-bromo-2-[[2-(5-methoxy-2-methyl-1H-indol-3-yl)acetyl]amino]benzoic acid Formula: C19H17BrN2O4 MolecularWeight: 417.25328

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1)C=CC(=C2)OC)CC(=O)NC3=C(C=CC(=C3)Br)C(=O)O

Isomeric SMILES

CC1=C(C2=C(N1)C=CC(=C2)OC)CC(=O)NC3=C(C=CC(=C3)Br)C(=O)O

InChI

InChI=1S/C19H17BrN2O4/c1-10-14(15-8-12(26-2)4-6-16(15)21-10)9-18(23)22-17-7-11(20)3-5-13(17)19(24)25/h3-8,21H,9H2,1-2H3,(H,22,23)(H,24,25)