14,16-diacetyloxy-8-azanyl-13-methyl-7,11-bis(oxidanylidene)-10-oxa-3-thia-6-azabicyclo[10.4.0]hexadeca-1(16),12,14-triene-5-carboxylate

Systemtic Name: 14,16-diacetyloxy-8-azanyl-13-methyl-7,11-bis(oxidanylidene)-10-oxa-3-thia-6-azabicyclo[10.4.0]hexadeca-1(16),12,14-triene-5-carboxylate Openeye Name: 14,16-diacetoxy-8-amino-13-methyl-7,11-dioxo-10-oxa-3-thia-6-azabicyclo[10.4.0]hexadeca-1(16),12,14-triene-5-carboxylate CAS Name: 14,16-diacetyloxy-8-amino-13-methyl-7,11-dioxo-10-oxa-3-thia-6-azabicyclo[10.4.0]hexadeca-1(16),12,14-triene-5-carboxylate IUPAC Name: 14,16-diacetyloxy-8-amino-13-methyl-7,11-dioxo-10-oxa-3-thia-6-azabicyclo[10.4.0]hexadeca-1(16),12,14-triene-5-carboxylate Traditional Name: 14,16-diacetoxy-8-amino-7,11-diketo-13-methyl-10-oxa-3-thia-6-azabicyclo[10.4.0]hexadeca-1(16),12,14-triene-5-carboxylate Formula: C19H21N2O9S- MolecularWeight: 453.44304

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C2=C1C(=O)OCC(C(=O)NC(CSC2)C(=O)[O-])N)OC(=O)C)OC(=O)C

Isomeric SMILES

CC1=C(C=C(C2=C1C(=O)OCC(C(=O)NC(CSC2)C(=O)[O-])N)OC(=O)C)OC(=O)C

InChI

InChI=1S/C19H22N2O9S/c1-8-14(29-9(2)22)4-15(30-10(3)23)11-6-31-7-13(18(25)26)21-17(24)12(20)5-28-19(27)16(8)11/h4,12-13H,5-7,20H2,1-3H3,(H,21,24)(H,25,26)/p-1