7-methyl-8-oxidanylidene-7-(2-phenylethanoylamino)-4-thia-1-azabicyclo[4.2.0]octane-2-carboxylic acid

Systemtic Name: 7-methyl-8-oxidanylidene-7-(2-phenylethanoylamino)-4-thia-1-azabicyclo[4.2.0]octane-2-carboxylic acid Openeye Name: 7-methyl-8-oxo-7-[(2-phenylacetyl)amino]-4-thia-1-azabicyclo[4.2.0]octane-2-carboxylic acid CAS Name: 7-methyl-8-oxo-7-[(1-oxo-2-phenylethyl)amino]-4-thia-1-azabicyclo[4.2.0]octane-2-carboxylic acid IUPAC Name: 7-methyl-8-oxo-7-[(2-phenylacetyl)amino]-4-thia-1-azabicyclo[4.2.0]octane-2-carboxylic acid Traditional Name: 8-keto-7-methyl-7-[(2-phenylacetyl)amino]-4-thia-1-azabicyclo[4.2.0]octane-2-carboxylic acid Formula: C16H18N2O4S MolecularWeight: 334.39012

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2CSCC(N2C1=O)C(=O)O)NC(=O)CC3=CC=CC=C3

Isomeric SMILES

CC1(C2CSCC(N2C1=O)C(=O)O)NC(=O)CC3=CC=CC=C3

InChI

InChI=1S/C16H18N2O4S/c1-16(17-13(19)7-10-5-3-2-4-6-10)12-9-23-8-11(14(20)21)18(12)15(16)22/h2-6,11-12H,7-9H2,1H3,(H,17,19)(H,20,21)