2-(1-azido-3-methyl-butyl)-1-methoxy-8-methyl-6-oxidanyl-10H-benzo[b][1,5]benzodioxocin-12-one

Systemtic Name: 2-(1-azido-3-methyl-butyl)-1-methoxy-8-methyl-6-oxidanyl-10H-benzo[b][1,5]benzodioxocin-12-one Openeye Name: 2-(1-azido-3-methyl-butyl)-6-hydroxy-1-methoxy-8-methyl-10H-benzo[b][1,5]benzodioxocin-12-one CAS Name: 2-(1-azido-3-methylbutyl)-6-hydroxy-1-methoxy-8-methyl-10H-benzo[b][1,5]benzodioxocin-12-one IUPAC Name: 2-(1-azido-3-methylbutyl)-6-hydroxy-1-methoxy-8-methyl-10H-benzo[b][1,5]benzodioxocin-12-one Traditional Name: 2-(1-azido-3-methyl-butyl)-6-hydroxy-1-methoxy-8-methyl-10H-benzo[b][1,5]benzodioxocin-12-one Formula: C21H23N3O5 MolecularWeight: 397.42442

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)COC(=O)C3=C(O2)C=CC(=C3OC)C(CC(C)C)N=[N+]=[N-])O

Isomeric SMILES

CC1=CC(=C2C(=C1)COC(=O)C3=C(O2)C=CC(=C3OC)C(CC(C)C)N=[N+]=[N-])O

InChI

InChI=1S/C21H23N3O5/c1-11(2)7-15(23-24-22)14-5-6-17-18(20(14)27-4)21(26)28-10-13-8-12(3)9-16(25)19(13)29-17/h5-6,8-9,11,15,25H,7,10H2,1-4H3