methyl (2S)-3-phenyl-2-[(3-piperidin-1-ylsulfonylphenyl)carbonylamino]propanoate

Systemtic Name: methyl (2S)-3-phenyl-2-[(3-piperidin-1-ylsulfonylphenyl)carbonylamino]propanoate Openeye Name: methyl (2S)-3-phenyl-2-[[3-(1-piperidylsulfonyl)benzoyl]amino]propanoate CAS Name: (2S)-2-[[oxo-[3-(1-piperidinylsulfonyl)phenyl]methyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl (2S)-3-phenyl-2-[(3-piperidin-1-ylsulfonylbenzoyl)amino]propanoate Traditional Name: (2S)-3-phenyl-2-[(3-piperidinosulfonylbenzoyl)amino]propionic acid methyl ester Formula: C22H26N2O5S MolecularWeight: 430.51724

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=CC=C1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

COC(=O)[C@H](CC1=CC=CC=C1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C22H26N2O5S/c1-29-22(26)20(15-17-9-4-2-5-10-17)23-21(25)18-11-8-12-19(16-18)30(27,28)24-13-6-3-7-14-24/h2,4-5,8-12,16,20H,3,6-7,13-15H2,1H3,(H,23,25)/t20-/m0/s1