4-[(2-ethoxy-5-piperidin-1-ylsulfonyl-phenyl)carbonylamino]butanoic acid

Systemtic Name: 4-[(2-ethoxy-5-piperidin-1-ylsulfonyl-phenyl)carbonylamino]butanoic acid Openeye Name: 4-[[2-ethoxy-5-(1-piperidylsulfonyl)benzoyl]amino]butanoic acid CAS Name: 4-[[[2-ethoxy-5-(1-piperidinylsulfonyl)phenyl]-oxomethyl]amino]butanoic acid IUPAC Name: 4-[(2-ethoxy-5-piperidin-1-ylsulfonylbenzoyl)amino]butanoic acid Traditional Name: 4-[(2-ethoxy-5-piperidinosulfonyl-benzoyl)amino]butyric acid Formula: C18H26N2O6S MolecularWeight: 398.47384

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)C(=O)NCCCC(=O)O

Isomeric SMILES

CCOC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)C(=O)NCCCC(=O)O

InChI

InChI=1S/C18H26N2O6S/c1-2-26-16-9-8-14(27(24,25)20-11-4-3-5-12-20)13-15(16)18(23)19-10-6-7-17(21)22/h8-9,13H,2-7,10-12H2,1H3,(H,19,23)(H,21,22)