methyl 2-methyl-2-[(1-naphthalen-2-ylsulfonylpiperidin-4-yl)carbonylamino]propanoate

Systemtic Name: methyl 2-methyl-2-[(1-naphthalen-2-ylsulfonylpiperidin-4-yl)carbonylamino]propanoate Openeye Name: methyl 2-methyl-2-[[1-(2-naphthylsulfonyl)piperidine-4-carbonyl]amino]propanoate CAS Name: 2-methyl-2-[[[1-(2-naphthalenylsulfonyl)-4-piperidinyl]-oxomethyl]amino]propanoic acid methyl ester IUPAC Name: methyl 2-methyl-2-[(1-naphthalen-2-ylsulfonylpiperidine-4-carbonyl)amino]propanoate Traditional Name: 2-methyl-2-[[1-(2-naphthylsulfonyl)isonipecotoyl]amino]propionic acid methyl ester Formula: C21H26N2O5S MolecularWeight: 418.50654

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)OC)NC(=O)C1CCN(CC1)S(=O)(=O)C2=CC3=CC=CC=C3C=C2

Isomeric SMILES

CC(C)(C(=O)OC)NC(=O)C1CCN(CC1)S(=O)(=O)C2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C21H26N2O5S/c1-21(2,20(25)28-3)22-19(24)16-10-12-23(13-11-16)29(26,27)18-9-8-15-6-4-5-7-17(15)14-18/h4-9,14,16H,10-13H2,1-3H3,(H,22,24)