(diphenylmethyl) 4-methoxy-7-[2-(4-methoxyphenyl)ethanoylamino]-3-methyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

Systemtic Name: (diphenylmethyl) 4-methoxy-7-[2-(4-methoxyphenyl)ethanoylamino]-3-methyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Openeye Name: benzhydryl 4-methoxy-7-[[2-(4-methoxyphenyl)acetyl]amino]-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate CAS Name: 4-methoxy-7-[[2-(4-methoxyphenyl)-1-oxoethyl]amino]-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid (diphenylmethyl) ester IUPAC Name: benzhydryl 4-methoxy-7-[[2-(4-methoxyphenyl)acetyl]amino]-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Traditional Name: 8-keto-4-methoxy-7-[[2-(4-methoxyphenyl)acetyl]amino]-3-methyl-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid benzhydryl ester Formula: C31H30N2O6S MolecularWeight: 558.6447

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N2C(C(C2=O)NC(=O)CC3=CC=C(C=C3)OC)SC1OC)C(=O)OC(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC1=C(N2C(C(C2=O)NC(=O)CC3=CC=C(C=C3)OC)SC1OC)C(=O)OC(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C31H30N2O6S/c1-19-26(30(36)39-27(21-10-6-4-7-11-21)22-12-8-5-9-13-22)33-28(35)25(29(33)40-31(19)38-3)32-24(34)18-20-14-16-23(37-2)17-15-20/h4-17,25,27,29,31H,18H2,1-3H3,(H,32,34)