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

Systemtic Name: 6-[(4-tert-butylphenyl)carbonylamino]-3-ethanoyl-7-oxidanylidene-1,3-diazabicyclo[3.2.0]heptane-2-carboxylic acid Openeye Name: 3-acetyl-6-[(4-tert-butylbenzoyl)amino]-7-oxo-1,3-diazabicyclo[3.2.0]heptane-2-carboxylic acid CAS Name: 3-acetyl-6-[[(4-tert-butylphenyl)-oxomethyl]amino]-7-oxo-1,3-diazabicyclo[3.2.0]heptane-2-carboxylic acid IUPAC Name: 3-acetyl-6-[(4-tert-butylbenzoyl)amino]-7-oxo-1,3-diazabicyclo[3.2.0]heptane-2-carboxylic acid Traditional Name: 3-acetyl-6-[(4-tert-butylbenzoyl)amino]-7-keto-1,3-diazabicyclo[3.2.0]heptane-2-carboxylic acid Formula: C19H23N3O5 MolecularWeight: 373.40302

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H23N3O5/c1-10(23)21-9-13-14(17(25)22(13)16(21)18(26)27)20-15(24)11-5-7-12(8-6-11)19(2,3)4/h5-8,13-14,16H,9H2,1-4H3,(H,20,24)(H,26,27)