ethyl 2-[2-acetamido-1,3-bis(ethoxycarbonyloxy)azulen-6-yl]ethanoate

Systemtic Name: ethyl 2-[2-acetamido-1,3-bis(ethoxycarbonyloxy)azulen-6-yl]ethanoate Openeye Name: ethyl 2-[2-acetamido-1,3-bis(ethoxycarbonyloxy)azulen-6-yl]acetate CAS Name: 2-[2-acetamido-1,3-bis(ethoxycarbonyloxy)-6-azulenyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-acetamido-1,3-bis(ethoxycarbonyloxy)azulen-6-yl]acetate Traditional Name: 2-(2-acetamido-1,3-dicarbethoxyoxy-azulen-6-yl)acetic acid ethyl ester Formula: C22H25NO9 MolecularWeight: 447.4352

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=CC=C2C(=C(C(=C2OC(=O)OCC)NC(=O)C)OC(=O)OCC)C=C1

Isomeric SMILES

CCOC(=O)CC1=CC=C2C(=C(C(=C2OC(=O)OCC)NC(=O)C)OC(=O)OCC)C=C1

InChI

InChI=1S/C22H25NO9/c1-5-28-17(25)12-14-8-10-15-16(11-9-14)20(32-22(27)30-7-3)18(23-13(4)24)19(15)31-21(26)29-6-2/h8-11H,5-7,12H2,1-4H3,(H,23,24)