5-nitro-7-[[13-[(5-nitro-8-oxidanyl-quinolin-7-yl)methyl]-1,10-dioxa-4,16-dithia-7,13-diazacyclooctadec-7-yl]methyl]quinolin-8-ol

Systemtic Name: 5-nitro-7-[[13-[(5-nitro-8-oxidanyl-quinolin-7-yl)methyl]-1,10-dioxa-4,16-dithia-7,13-diazacyclooctadec-7-yl]methyl]quinolin-8-ol Openeye Name: 7-[[13-[(8-hydroxy-5-nitro-7-quinolyl)methyl]-1,10-dioxa-4,16-dithia-7,13-diazacyclooctadec-7-yl]methyl]-5-nitro-quinolin-8-ol CAS Name: 7-[[13-[(8-hydroxy-5-nitro-7-quinolinyl)methyl]-1,10-dioxa-4,16-dithia-7,13-diazacyclooctadec-7-yl]methyl]-5-nitro-8-quinolinol IUPAC Name: 7-[[13-[(8-hydroxy-5-nitroquinolin-7-yl)methyl]-1,10-dioxa-4,16-dithia-7,13-diazacyclooctadec-7-yl]methyl]-5-nitroquinolin-8-ol Traditional Name: 7-[[13-[(8-hydroxy-5-nitro-7-quinolyl)methyl]-1,10-dioxa-4,16-dithia-7,13-diazacyclooctadec-7-yl]methyl]-5-nitro-quinolin-8-ol Formula: C32H38N6O8S2 MolecularWeight: 698.80952

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN(CCSCCOCCSCCN1CC2=CC(=C3C=CC=NC3=C2O)[N+](=O)[O-])CC4=CC(=C5C=CC=NC5=C4O)[N+](=O)[O-]

Isomeric SMILES

C1COCCN(CCSCCOCCSCCN1CC2=CC(=C3C=CC=NC3=C2O)[N+](=O)[O-])CC4=CC(=C5C=CC=NC5=C4O)[N+](=O)[O-]

InChI

InChI=1S/C32H38N6O8S2/c39-31-23(19-27(37(41)42)25-3-1-5-33-29(25)31)21-35-7-11-45-12-8-36(10-16-48-18-14-46-13-17-47-15-9-35)22-24-20-28(38(43)44)26-4-2-6-34-30(26)32(24)40/h1-6,19-20,39-40H,7-18,21-22H2