N-(6-azanylhexyl)-4-methoxy-3-nitro-4-oxidanyl-cyclohexa-2,5-diene-1-carboxamide

Systemtic Name: N-(6-azanylhexyl)-4-methoxy-3-nitro-4-oxidanyl-cyclohexa-2,5-diene-1-carboxamide Openeye Name: N-(6-aminohexyl)-4-hydroxy-4-methoxy-3-nitro-cyclohexa-2,5-diene-1-carboxamide CAS Name: N-(6-aminohexyl)-4-hydroxy-4-methoxy-3-nitro-1-cyclohexa-2,5-dienecarboxamide IUPAC Name: N-(6-aminohexyl)-4-hydroxy-4-methoxy-3-nitrocyclohexa-2,5-diene-1-carboxamide Traditional Name: N-(6-aminohexyl)-4-hydroxy-4-methoxy-3-nitro-cyclohexa-2,5-diene-1-carboxamide Formula: C14H23N3O5 MolecularWeight: 313.34952

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Descriptors Computed from Structure

Canonical SMILES:

COC1(C=CC(C=C1[N+](=O)[O-])C(=O)NCCCCCCN)O

Isomeric SMILES

COC1(C=CC(C=C1[N+](=O)[O-])C(=O)NCCCCCCN)O

InChI

InChI=1S/C14H23N3O5/c1-22-14(19)7-6-11(10-12(14)17(20)21)13(18)16-9-5-3-2-4-8-15/h6-7,10-11,19H,2-5,8-9,15H2,1H3,(H,16,18)