butylamino (3S)-2-oxidanylidene-3-(2-phenylethanoylamino)azetidine-1-sulfonate

Systemtic Name: butylamino (3S)-2-oxidanylidene-3-(2-phenylethanoylamino)azetidine-1-sulfonate Openeye Name: butylamino (3S)-2-oxo-3-[(2-phenylacetyl)amino]azetidine-1-sulfonate CAS Name: (3S)-2-oxo-3-[(1-oxo-2-phenylethyl)amino]-1-azetidinesulfonic acid butylamino ester IUPAC Name: butylamino (3S)-2-oxo-3-[(2-phenylacetyl)amino]azetidine-1-sulfonate Traditional Name: (3S)-2-keto-3-[(2-phenylacetyl)amino]azetidine-1-sulfonic acid butylamino ester Formula: C15H21N3O5S MolecularWeight: 355.40934

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNOS(=O)(=O)N1CC(C1=O)NC(=O)CC2=CC=CC=C2

Isomeric SMILES

CCCCNOS(=O)(=O)N1C[C@@H](C1=O)NC(=O)CC2=CC=CC=C2

InChI

InChI=1S/C15H21N3O5S/c1-2-3-9-16-23-24(21,22)18-11-13(15(18)20)17-14(19)10-12-7-5-4-6-8-12/h4-8,13,16H,2-3,9-11H2,1H3,(H,17,19)/t13-/m0/s1