4-[2-morpholin-4-ylsulfonylethyl(pyridin-4-ylmethyl)amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[2-morpholin-4-ylsulfonylethyl(pyridin-4-ylmethyl)amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[2-morpholinosulfonylethyl(4-pyridylmethyl)amino]-4-oxo-butanoic acid CAS Name: 4-[2-(4-morpholinylsulfonyl)ethyl-(pyridin-4-ylmethyl)amino]-4-oxobutanoic acid IUPAC Name: 4-[2-morpholin-4-ylsulfonylethyl(pyridin-4-ylmethyl)amino]-4-oxobutanoic acid Traditional Name: 4-keto-4-[2-morpholinosulfonylethyl(4-pyridylmethyl)amino]butyric acid Formula: C16H23N3O6S MolecularWeight: 385.43532

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)CCN(CC2=CC=NC=C2)C(=O)CCC(=O)O

Isomeric SMILES

C1COCCN1S(=O)(=O)CCN(CC2=CC=NC=C2)C(=O)CCC(=O)O

InChI

InChI=1S/C16H23N3O6S/c20-15(1-2-16(21)22)18(13-14-3-5-17-6-4-14)9-12-26(23,24)19-7-10-25-11-8-19/h3-6H,1-2,7-13H2,(H,21,22)