3-(methoxymethoxymethyl)-8-oxidanylidene-7-[(phenylmethylidene)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

Systemtic Name: 3-(methoxymethoxymethyl)-8-oxidanylidene-7-[(phenylmethylidene)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Openeye Name: 7-(benzylideneamino)-3-(methoxymethoxymethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate CAS Name: 3-(methoxymethoxymethyl)-8-oxo-7-[(phenylmethylene)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate IUPAC Name: 7-(benzylideneamino)-3-(methoxymethoxymethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Traditional Name: 7-(benzalamino)-8-keto-3-(methoxymethoxymethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Formula: C17H17N2O5S- MolecularWeight: 361.39228

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Descriptors Computed from Structure

Canonical SMILES:

COCOCC1=C(N2C(C(C2=O)N=CC3=CC=CC=C3)SC1)C(=O)[O-]

Isomeric SMILES

COCOCC1=C(N2C(C(C2=O)N=CC3=CC=CC=C3)SC1)C(=O)[O-]

InChI

InChI=1S/C17H18N2O5S/c1-23-10-24-8-12-9-25-16-13(15(20)19(16)14(12)17(21)22)18-7-11-5-3-2-4-6-11/h2-7,13,16H,8-10H2,1H3,(H,21,22)/p-1