3-ethanoyl-6-[(4-ethylphenyl)carbonylamino]-7-oxidanylidene-1,3-diazabicyclo[3.2.0]heptane-2-carboxylic acid

Systemtic Name: 3-ethanoyl-6-[(4-ethylphenyl)carbonylamino]-7-oxidanylidene-1,3-diazabicyclo[3.2.0]heptane-2-carboxylic acid Openeye Name: 3-acetyl-6-[(4-ethylbenzoyl)amino]-7-oxo-1,3-diazabicyclo[3.2.0]heptane-2-carboxylic acid CAS Name: 3-acetyl-6-[[(4-ethylphenyl)-oxomethyl]amino]-7-oxo-1,3-diazabicyclo[3.2.0]heptane-2-carboxylic acid IUPAC Name: 3-acetyl-6-[(4-ethylbenzoyl)amino]-7-oxo-1,3-diazabicyclo[3.2.0]heptane-2-carboxylic acid Traditional Name: 3-acetyl-6-[(4-ethylbenzoyl)amino]-7-keto-1,3-diazabicyclo[3.2.0]heptane-2-carboxylic acid Formula: C17H19N3O5 MolecularWeight: 345.34986

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)NC2C3CN(C(N3C2=O)C(=O)O)C(=O)C

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)NC2C3CN(C(N3C2=O)C(=O)O)C(=O)C

InChI

InChI=1S/C17H19N3O5/c1-3-10-4-6-11(7-5-10)14(22)18-13-12-8-19(9(2)21)15(17(24)25)20(12)16(13)23/h4-7,12-13,15H,3,8H2,1-2H3,(H,18,22)(H,24,25)