3-bromanyl-5-methoxy-4-[2-[(3-methylphenyl)amino]-2-oxidanylidene-ethoxy]benzoic acid

Systemtic Name: 3-bromanyl-5-methoxy-4-[2-[(3-methylphenyl)amino]-2-oxidanylidene-ethoxy]benzoic acid Openeye Name: 3-bromo-5-methoxy-4-[2-(3-methylanilino)-2-oxo-ethoxy]benzoic acid CAS Name: 3-bromo-5-methoxy-4-[2-(3-methylanilino)-2-oxoethoxy]benzoic acid IUPAC Name: 3-bromo-5-methoxy-4-[2-(3-methylanilino)-2-oxoethoxy]benzoic acid Traditional Name: 3-bromo-4-[2-keto-2-(m-toluidino)ethoxy]-5-methoxy-benzoic acid Formula: C17H16BrNO5 MolecularWeight: 394.21664

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)COC2=C(C=C(C=C2Br)C(=O)O)OC

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)COC2=C(C=C(C=C2Br)C(=O)O)OC

InChI

InChI=1S/C17H16BrNO5/c1-10-4-3-5-12(6-10)19-15(20)9-24-16-13(18)7-11(17(21)22)8-14(16)23-2/h3-8H,9H2,1-2H3,(H,19,20)(H,21,22)