3-butanoyl-7-oxidanylidene-6-(2-phenoxyethanoylamino)-1,3-diazabicyclo[3.2.0]heptane-2-carboxylic acid

Systemtic Name: 3-butanoyl-7-oxidanylidene-6-(2-phenoxyethanoylamino)-1,3-diazabicyclo[3.2.0]heptane-2-carboxylic acid Openeye Name: 3-butanoyl-7-oxo-6-[(2-phenoxyacetyl)amino]-1,3-diazabicyclo[3.2.0]heptane-2-carboxylic acid CAS Name: 7-oxo-3-(1-oxobutyl)-6-[(1-oxo-2-phenoxyethyl)amino]-1,3-diazabicyclo[3.2.0]heptane-2-carboxylic acid IUPAC Name: 3-butanoyl-7-oxo-6-[(2-phenoxyacetyl)amino]-1,3-diazabicyclo[3.2.0]heptane-2-carboxylic acid Traditional Name: 3-butyryl-7-keto-6-[(2-phenoxyacetyl)amino]-1,3-diazabicyclo[3.2.0]heptane-2-carboxylic acid Formula: C18H21N3O6 MolecularWeight: 375.37584

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N1CC2C(C(=O)N2C1C(=O)O)NC(=O)COC3=CC=CC=C3

Isomeric SMILES

CCCC(=O)N1CC2C(C(=O)N2C1C(=O)O)NC(=O)COC3=CC=CC=C3

InChI

InChI=1S/C18H21N3O6/c1-2-6-14(23)20-9-12-15(17(24)21(12)16(20)18(25)26)19-13(22)10-27-11-7-4-3-5-8-11/h3-5,7-8,12,15-16H,2,6,9-10H2,1H3,(H,19,22)(H,25,26)