(diphenylmethyl) 3-(acetyloxymethyl)-7-[[(Z)-(3-tert-butyl-5-methyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]amino]-7-methoxy-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

Systemtic Name: (diphenylmethyl) 3-(acetyloxymethyl)-7-[[(Z)-(3-tert-butyl-5-methyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]amino]-7-methoxy-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Openeye Name: benzhydryl 3-(acetoxymethyl)-7-[[(Z)-(3-tert-butyl-5-methyl-4-oxo-cyclohexa-2,5-dien-1-ylidene)methyl]amino]-7-methoxy-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate CAS Name: 3-(acetyloxymethyl)-7-[[(Z)-(3-tert-butyl-5-methyl-4-oxo-1-cyclohexa-2,5-dienylidene)methyl]amino]-7-methoxy-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid (diphenylmethyl) ester IUPAC Name: benzhydryl 3-(acetyloxymethyl)-7-[[(Z)-(3-tert-butyl-5-methyl-4-oxocyclohexa-2,5-dien-1-ylidene)methyl]amino]-7-methoxy-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Traditional Name: 3-(acetoxymethyl)-7-[[(Z)-(3-tert-butyl-4-keto-5-methyl-cyclohexa-2,5-dien-1-ylidene)methyl]amino]-8-keto-7-methoxy-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid benzhydryl ester Formula: C36H38N2O7S MolecularWeight: 642.76112

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Descriptors Computed from Structure

Canonical SMILES:

CC1=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)C

Isomeric SMILES

CC1=C/C(=C/NC2(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)C

InChI

InChI=1S/C36H38N2O7S/c1-22-17-24(18-28(30(22)40)35(3,4)5)19-37-36(43-6)33(42)38-29(27(20-44-23(2)39)21-46-34(36)38)32(41)45-31(25-13-9-7-10-14-25)26-15-11-8-12-16-26/h7-19,31,34,37H,20-21H2,1-6H3/b24-19-