(4R,5S,6S,7R)-1,3-bis[(4E)-4-(4-fluorophenyl)-4-hydroxyimino-butyl]-5,6-bis(oxidanyl)-4,7-bis(phenylmethyl)-1,3-diazepan-2-one

Systemtic Name: (4R,5S,6S,7R)-1,3-bis[(4E)-4-(4-fluorophenyl)-4-hydroxyimino-butyl]-5,6-bis(oxidanyl)-4,7-bis(phenylmethyl)-1,3-diazepan-2-one Openeye Name: (4R,5S,6S,7R)-4,7-dibenzyl-1,3-bis[(4E)-4-(4-fluorophenyl)-4-hydroxyimino-butyl]-5,6-dihydroxy-1,3-diazepan-2-one CAS Name: (4R,5S,6S,7R)-1,3-bis[(4E)-4-(4-fluorophenyl)-4-hydroxyiminobutyl]-5,6-dihydroxy-4,7-bis(phenylmethyl)-1,3-diazepan-2-one IUPAC Name: (4R,5S,6S,7R)-4,7-dibenzyl-1,3-bis[(4E)-4-(4-fluorophenyl)-4-hydroxyiminobutyl]-5,6-dihydroxy-1,3-diazepan-2-one Traditional Name: (4R,5S,6S,7R)-4,7-dibenzyl-1,3-bis[(4E)-4-(4-fluorophenyl)-4-hydroximino-butyl]-5,6-dihydroxy-1,3-diazepan-2-one Formula: C39H42F2N4O5 MolecularWeight: 684.771386

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2C(C(C(N(C(=O)N2CCCC(=NO)C3=CC=C(C=C3)F)CCCC(=NO)C4=CC=C(C=C4)F)CC5=CC=CC=C5)O)O

Isomeric SMILES

C1=CC=C(C=C1)C[C@H]2N(C(=O)N([C@@H]([C@@H]([C@H]2O)O)CC3=CC=CC=C3)CCC/C(=N\O)/C4=CC=C(C=C4)F)CCC/C(=N\O)/C5=CC=C(C=C5)F

InChI

InChI=1S/C39H42F2N4O5/c40-31-19-15-29(16-20-31)33(42-49)13-7-23-44-35(25-27-9-3-1-4-10-27)37(46)38(47)36(26-28-11-5-2-6-12-28)45(39(44)48)24-8-14-34(43-50)30-17-21-32(41)22-18-30/h1-6,9-12,15-22,35-38,46-47,49-50H,7-8,13-14,23-26H2/b42-33+,43-34+/t35-,36-,37+,38+/m1/s1