(diphenylmethyl) 3-carbonazidoyl-7-(2-chloranylethanoylamino)-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-3-ene-2-carboxylate

Systemtic Name: (diphenylmethyl) 3-carbonazidoyl-7-(2-chloranylethanoylamino)-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-3-ene-2-carboxylate Openeye Name: benzhydryl 3-carbonazidoyl-7-[(2-chloroacetyl)amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-3-ene-2-carboxylate CAS Name: 3-carbonazidoyl-7-[(2-chloro-1-oxoethyl)amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-3-ene-2-carboxylic acid (diphenylmethyl) ester IUPAC Name: benzhydryl 3-carbonazidoyl-7-[(2-chloroacetyl)amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-3-ene-2-carboxylate Traditional Name: 3-carbonazidoyl-7-[(2-chloroacetyl)amino]-8-keto-5-thia-1-azabicyclo[4.2.0]oct-3-ene-2-carboxylic acid benzhydryl ester Formula: C23H18ClN5O5S MolecularWeight: 511.93752

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CC=C2)OC(=O)C3C(=CSC4N3C(=O)C4NC(=O)CCl)C(=O)N=[N+]=[N-]

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)OC(=O)C3C(=CSC4N3C(=O)C4NC(=O)CCl)C(=O)N=[N+]=[N-]

InChI

InChI=1S/C23H18ClN5O5S/c24-11-16(30)26-17-21(32)29-18(15(12-35-22(17)29)20(31)27-28-25)23(33)34-19(13-7-3-1-4-8-13)14-9-5-2-6-10-14/h1-10,12,17-19,22H,11H2,(H,26,30)