ethyl 2-acetamido-3-[(2-acetamido-3-ethoxycarbonyl-azulen-1-yl)methyl]azulene-1-carboxylate

Systemtic Name: ethyl 2-acetamido-3-[(2-acetamido-3-ethoxycarbonyl-azulen-1-yl)methyl]azulene-1-carboxylate Openeye Name: ethyl 2-acetamido-3-[(2-acetamido-3-ethoxycarbonyl-azulen-1-yl)methyl]azulene-1-carboxylate CAS Name: 2-acetamido-3-[(2-acetamido-3-ethoxycarbonyl-1-azulenyl)methyl]-1-azulenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-acetamido-3-[(2-acetamido-3-ethoxycarbonylazulen-1-yl)methyl]azulene-1-carboxylate Traditional Name: 2-acetamido-3-[(2-acetamido-3-carbethoxy-azulen-1-yl)methyl]azulene-1-carboxylic acid ethyl ester Formula: C31H30N2O6 MolecularWeight: 526.5797

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C2C1=CC=CC=C2)CC3=C4C=CC=CC=C4C(=C3NC(=O)C)C(=O)OCC)NC(=O)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C2C1=CC=CC=C2)CC3=C4C=CC=CC=C4C(=C3NC(=O)C)C(=O)OCC)NC(=O)C

InChI

InChI=1S/C31H30N2O6/c1-5-38-30(36)26-22-15-11-7-9-13-20(22)24(28(26)32-18(3)34)17-25-21-14-10-8-12-16-23(21)27(31(37)39-6-2)29(25)33-19(4)35/h7-16H,5-6,17H2,1-4H3,(H,32,34)(H,33,35)