(1-oxidanylidene-1-phenylazanyl-propan-2-yl) 3-(4-piperidin-1-ylsulfonylphenyl)propanoate

Systemtic Name: (1-oxidanylidene-1-phenylazanyl-propan-2-yl) 3-(4-piperidin-1-ylsulfonylphenyl)propanoate Openeye Name: (2-anilino-1-methyl-2-oxo-ethyl) 3-[4-(1-piperidylsulfonyl)phenyl]propanoate CAS Name: 3-[4-(1-piperidinylsulfonyl)phenyl]propanoic acid (1-anilino-1-oxopropan-2-yl) ester IUPAC Name: (1-anilino-1-oxopropan-2-yl) 3-(4-piperidin-1-ylsulfonylphenyl)propanoate Traditional Name: 3-(4-piperidinosulfonylphenyl)propionic acid (2-anilino-2-keto-1-methyl-ethyl) ester Formula: C23H28N2O5S MolecularWeight: 444.54382

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1)OC(=O)CCC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC(C(=O)NC1=CC=CC=C1)OC(=O)CCC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C23H28N2O5S/c1-18(23(27)24-20-8-4-2-5-9-20)30-22(26)15-12-19-10-13-21(14-11-19)31(28,29)25-16-6-3-7-17-25/h2,4-5,8-11,13-14,18H,3,6-7,12,15-17H2,1H3,(H,24,27)