1-butoxy-2-oxidanylidene-3-(2-phenylethanoylamino)azetidine-3-sulfonic acid

Systemtic Name: 1-butoxy-2-oxidanylidene-3-(2-phenylethanoylamino)azetidine-3-sulfonic acid Openeye Name: 1-butoxy-2-oxo-3-[(2-phenylacetyl)amino]azetidine-3-sulfonic acid CAS Name: 1-butoxy-2-oxo-3-[(1-oxo-2-phenylethyl)amino]-3-azetidinesulfonic acid IUPAC Name: 1-butoxy-2-oxo-3-[(2-phenylacetyl)amino]azetidine-3-sulfonic acid Traditional Name: 1-butoxy-2-keto-3-[(2-phenylacetyl)amino]azetidine-3-sulfonic acid Formula: C15H20N2O6S MolecularWeight: 356.3941

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Descriptors Computed from Structure

Canonical SMILES:

CCCCON1CC(C1=O)(NC(=O)CC2=CC=CC=C2)S(=O)(=O)O

Isomeric SMILES

CCCCON1CC(C1=O)(NC(=O)CC2=CC=CC=C2)S(=O)(=O)O

InChI

InChI=1S/C15H20N2O6S/c1-2-3-9-23-17-11-15(14(17)19,24(20,21)22)16-13(18)10-12-7-5-4-6-8-12/h4-8H,2-3,9-11H2,1H3,(H,16,18)(H,20,21,22)