[2-[(4-bromanyl-3-chloranyl-phenyl)amino]-2-oxidanylidene-ethyl] 3-naphthalen-2-ylsulfonylpropanoate

Systemtic Name: [2-[(4-bromanyl-3-chloranyl-phenyl)amino]-2-oxidanylidene-ethyl] 3-naphthalen-2-ylsulfonylpropanoate Openeye Name: [2-(4-bromo-3-chloro-anilino)-2-oxo-ethyl] 3-(2-naphthylsulfonyl)propanoate CAS Name: 3-(2-naphthalenylsulfonyl)propanoic acid [2-(4-bromo-3-chloroanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-bromo-3-chloroanilino)-2-oxoethyl] 3-naphthalen-2-ylsulfonylpropanoate Traditional Name: 3-(2-naphthylsulfonyl)propionic acid [2-(4-bromo-3-chloro-anilino)-2-keto-ethyl] ester Formula: C21H17BrClNO5S MolecularWeight: 510.78538

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)S(=O)(=O)CCC(=O)OCC(=O)NC3=CC(=C(C=C3)Br)Cl

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)S(=O)(=O)CCC(=O)OCC(=O)NC3=CC(=C(C=C3)Br)Cl

InChI

InChI=1S/C21H17BrClNO5S/c22-18-8-6-16(12-19(18)23)24-20(25)13-29-21(26)9-10-30(27,28)17-7-5-14-3-1-2-4-15(14)11-17/h1-8,11-12H,9-10,13H2,(H,24,25)