ethyl 4-methyl-3-[2-[methylsulfonyl(naphthalen-1-yl)amino]ethanoylamino]benzoate

Systemtic Name: ethyl 4-methyl-3-[2-[methylsulfonyl(naphthalen-1-yl)amino]ethanoylamino]benzoate Openeye Name: ethyl 4-methyl-3-[[2-[methylsulfonyl(1-naphthyl)amino]acetyl]amino]benzoate CAS Name: 4-methyl-3-[[2-[methylsulfonyl(1-naphthalenyl)amino]-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-methyl-3-[[2-[methylsulfonyl(naphthalen-1-yl)amino]acetyl]amino]benzoate Traditional Name: 3-[[2-[mesyl(1-naphthyl)amino]acetyl]amino]-4-methyl-benzoic acid ethyl ester Formula: C23H24N2O5S MolecularWeight: 440.51206

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1)C)NC(=O)CN(C2=CC=CC3=CC=CC=C32)S(=O)(=O)C

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1)C)NC(=O)CN(C2=CC=CC3=CC=CC=C32)S(=O)(=O)C

InChI

InChI=1S/C23H24N2O5S/c1-4-30-23(27)18-13-12-16(2)20(14-18)24-22(26)15-25(31(3,28)29)21-11-7-9-17-8-5-6-10-19(17)21/h5-14H,4,15H2,1-3H3,(H,24,26)