(1R,6S)-1-oxidanyl-6-[(S)-oxidanyl-[(4S)-2,2,4-trimethyl-1,3-dioxolan-4-yl]methyl]-2-(quinolin-6-ylmethylsulfanylmethyl)-5-oxa-8,10-diazabicyclo[4.2.2]decane-7,9-dione

Systemtic Name: (1R,6S)-1-oxidanyl-6-[(S)-oxidanyl-[(4S)-2,2,4-trimethyl-1,3-dioxolan-4-yl]methyl]-2-(quinolin-6-ylmethylsulfanylmethyl)-5-oxa-8,10-diazabicyclo[4.2.2]decane-7,9-dione Openeye Name: (1R,6S)-1-hydroxy-6-[(S)-hydroxy-[(4S)-2,2,4-trimethyl-1,3-dioxolan-4-yl]methyl]-2-(6-quinolylmethylsulfanylmethyl)-5-oxa-8,10-diazabicyclo[4.2.2]decane-7,9-dione CAS Name: (1R,6S)-1-hydroxy-6-[(S)-hydroxy-[(4S)-2,2,4-trimethyl-1,3-dioxolan-4-yl]methyl]-2-[(6-quinolinylmethylthio)methyl]-5-oxa-8,10-diazabicyclo[4.2.2]decane-7,9-dione IUPAC Name: (1R,6S)-1-hydroxy-6-[(S)-hydroxy-[(4S)-2,2,4-trimethyl-1,3-dioxolan-4-yl]methyl]-2-(quinolin-6-ylmethylsulfanylmethyl)-5-oxa-8,10-diazabicyclo[4.2.2]decane-7,9-dione Traditional Name: (1R,6S)-1-hydroxy-6-[(S)-hydroxy-[(4S)-2,2,4-trimethyl-1,3-dioxolan-4-yl]methyl]-2-[(6-quinolylmethylthio)methyl]-5-oxa-8,10-diazabicyclo[4.2.2]decane-7,9-quinone Formula: C25H31N3O7S MolecularWeight: 517.59454

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OCC(O1)(C)C(C23C(=O)NC(C(CCO2)CSCC4=CC5=C(C=C4)N=CC=C5)(C(=O)N3)O)O)C

Isomeric SMILES

C[C@]1(COC(O1)(C)C)[C@@H]([C@@]23C(=O)N[C@@](C(CCO2)CSCC4=CC5=C(C=C4)N=CC=C5)(C(=O)N3)O)O

InChI

InChI=1S/C25H31N3O7S/c1-22(2)34-14-23(3,35-22)19(29)25-21(31)27-24(32,20(30)28-25)17(8-10-33-25)13-36-12-15-6-7-18-16(11-15)5-4-9-26-18/h4-7,9,11,17,19,29,32H,8,10,12-14H2,1-3H3,(H,27,31)(H,28,30)/t17?,19-,23-,24+,25-/m0/s1