(E)-2-methoxy-8,8-dimethyl-3,4,5-tris(oxidanyl)-N-(6-oxidanyl-2-oxidanylidene-azepan-3-yl)non-6-enamide

Systemtic Name: (E)-2-methoxy-8,8-dimethyl-3,4,5-tris(oxidanyl)-N-(6-oxidanyl-2-oxidanylidene-azepan-3-yl)non-6-enamide Openeye Name: (E)-3,4,5-trihydroxy-N-(6-hydroxy-2-oxo-azepan-3-yl)-2-methoxy-8,8-dimethyl-non-6-enamide CAS Name: (E)-3,4,5-trihydroxy-N-(6-hydroxy-2-oxo-3-azepanyl)-2-methoxy-8,8-dimethyl-6-nonenamide IUPAC Name: (E)-3,4,5-trihydroxy-N-(6-hydroxy-2-oxoazepan-3-yl)-2-methoxy-8,8-dimethylnon-6-enamide Traditional Name: (E)-3,4,5-trihydroxy-N-(6-hydroxy-2-keto-azepan-3-yl)-2-methoxy-8,8-dimethyl-non-6-enamide Formula: C18H32N2O7 MolecularWeight: 388.45588

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C=CC(C(C(C(C(=O)NC1CCC(CNC1=O)O)OC)O)O)O

Isomeric SMILES

CC(C)(C)/C=C/C(C(C(C(C(=O)NC1CCC(CNC1=O)O)OC)O)O)O

InChI

InChI=1S/C18H32N2O7/c1-18(2,3)8-7-12(22)13(23)14(24)15(27-4)17(26)20-11-6-5-10(21)9-19-16(11)25/h7-8,10-15,21-24H,5-6,9H2,1-4H3,(H,19,25)(H,20,26)/b8-7+