methyl 2-[5-[(E)-hydroxyiminomethyl]-3,6-dimethoxy-9,9-dimethyl-xanthen-4-yl]ethanoate

Systemtic Name: methyl 2-[5-[(E)-hydroxyiminomethyl]-3,6-dimethoxy-9,9-dimethyl-xanthen-4-yl]ethanoate Openeye Name: methyl 2-[5-[(E)-hydroxyiminomethyl]-3,6-dimethoxy-9,9-dimethyl-xanthen-4-yl]acetate CAS Name: 2-[5-[(E)-hydroxyiminomethyl]-3,6-dimethoxy-9,9-dimethyl-4-xanthenyl]acetic acid methyl ester IUPAC Name: methyl 2-[5-[(E)-hydroxyiminomethyl]-3,6-dimethoxy-9,9-dimethylxanthen-4-yl]acetate Traditional Name: 2-[5-[(E)-hydroximinomethyl]-3,6-dimethoxy-9,9-dimethyl-xanthen-4-yl]acetic acid methyl ester Formula: C21H23NO6 MolecularWeight: 385.41042

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=C(C(=C(C=C2)OC)CC(=O)OC)OC3=C1C=CC(=C3C=NO)OC)C

Isomeric SMILES

CC1(C2=C(C(=C(C=C2)OC)CC(=O)OC)OC3=C1C=CC(=C3/C=N/O)OC)C

InChI

InChI=1S/C21H23NO6/c1-21(2)14-6-8-16(25-3)12(10-18(23)27-5)19(14)28-20-13(11-22-24)17(26-4)9-7-15(20)21/h6-9,11,24H,10H2,1-5H3/b22-11+