(diphenylmethyl) 3-(acetyloxymethyl)-7-methoxy-8-oxidanylidene-7-[[4-oxidanylidene-3,5-di(propan-2-yl)cyclohexa-2,5-dien-1-ylidene]methylamino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

Systemtic Name: (diphenylmethyl) 3-(acetyloxymethyl)-7-methoxy-8-oxidanylidene-7-[[4-oxidanylidene-3,5-di(propan-2-yl)cyclohexa-2,5-dien-1-ylidene]methylamino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Openeye Name: benzhydryl 3-(acetoxymethyl)-7-[(3,5-diisopropyl-4-oxo-cyclohexa-2,5-dien-1-ylidene)methylamino]-7-methoxy-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate CAS Name: 3-(acetyloxymethyl)-7-methoxy-8-oxo-7-[[4-oxo-3,5-di(propan-2-yl)-1-cyclohexa-2,5-dienylidene]methylamino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid (diphenylmethyl) ester IUPAC Name: benzhydryl 3-(acetyloxymethyl)-7-methoxy-8-oxo-7-[[4-oxo-3,5-di(propan-2-yl)cyclohexa-2,5-dien-1-ylidene]methylamino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Traditional Name: 3-(acetoxymethyl)-7-[(3,5-diisopropyl-4-keto-cyclohexa-2,5-dien-1-ylidene)methylamino]-8-keto-7-methoxy-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid benzhydryl ester Formula: C37H40N2O7S MolecularWeight: 656.7877

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=CNC2(C3N(C2=O)C(=C(CS3)COC(=O)C)C(=O)OC(C4=CC=CC=C4)C5=CC=CC=C5)OC)C=C(C1=O)C(C)C

Isomeric SMILES

CC(C)C1=CC(=CNC2(C3N(C2=O)C(=C(CS3)COC(=O)C)C(=O)OC(C4=CC=CC=C4)C5=CC=CC=C5)OC)C=C(C1=O)C(C)C

InChI

InChI=1S/C37H40N2O7S/c1-22(2)29-17-25(18-30(23(3)4)32(29)41)19-38-37(44-6)35(43)39-31(28(20-45-24(5)40)21-47-36(37)39)34(42)46-33(26-13-9-7-10-14-26)27-15-11-8-12-16-27/h7-19,22-23,33,36,38H,20-21H2,1-6H3