(7-acetamido-1,3,10-trimethoxy-9-oxidanylidene-6,7-dihydro-5H-benzo[a]heptalen-2-yl) ethanoate

Systemtic Name: (7-acetamido-1,3,10-trimethoxy-9-oxidanylidene-6,7-dihydro-5H-benzo[a]heptalen-2-yl) ethanoate Openeye Name: (7-acetamido-1,3,10-trimethoxy-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-2-yl) acetate CAS Name: acetic acid (7-acetamido-1,3,10-trimethoxy-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-2-yl) ester IUPAC Name: (7-acetamido-1,3,10-trimethoxy-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-2-yl) acetate Traditional Name: acetic acid (7-acetamido-9-keto-1,3,10-trimethoxy-6,7-dihydro-5H-benzo[a]heptalen-2-yl) ester Formula: C23H25NO7 MolecularWeight: 427.4471

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1CCC2=CC(=C(C(=C2C3=CC=C(C(=O)C=C13)OC)OC)OC(=O)C)OC

Isomeric SMILES

CC(=O)NC1CCC2=CC(=C(C(=C2C3=CC=C(C(=O)C=C13)OC)OC)OC(=O)C)OC

InChI

InChI=1S/C23H25NO7/c1-12(25)24-17-8-6-14-10-20(29-4)22(31-13(2)26)23(30-5)21(14)15-7-9-19(28-3)18(27)11-16(15)17/h7,9-11,17H,6,8H2,1-5H3,(H,24,25)