methyl 3-[(E)-4-(3-methoxycarbonylazulen-1-yl)-4-oxidanylidene-but-2-en-2-yl]azulene-1-carboxylate

Systemtic Name: methyl 3-[(E)-4-(3-methoxycarbonylazulen-1-yl)-4-oxidanylidene-but-2-en-2-yl]azulene-1-carboxylate Openeye Name: methyl 3-[(E)-3-(3-methoxycarbonylazulen-1-yl)-1-methyl-3-oxo-prop-1-enyl]azulene-1-carboxylate CAS Name: 3-[(E)-4-(3-methoxycarbonyl-1-azulenyl)-4-oxobut-2-en-2-yl]-1-azulenecarboxylic acid methyl ester IUPAC Name: methyl 3-[(E)-4-(3-methoxycarbonylazulen-1-yl)-4-oxobut-2-en-2-yl]azulene-1-carboxylate Traditional Name: 3-[(E)-3-(3-carbomethoxyazulen-1-yl)-3-keto-1-methyl-prop-1-enyl]azulene-1-carboxylic acid methyl ester Formula: C28H22O5 MolecularWeight: 438.47128

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)C1=CC(=C2C1=CC=CC=C2)C(=O)OC)C3=CC(=C4C3=CC=CC=C4)C(=O)OC

Isomeric SMILES

C/C(=C\C(=O)C1=CC(=C2C1=CC=CC=C2)C(=O)OC)/C3=CC(=C4C3=CC=CC=C4)C(=O)OC

InChI

InChI=1S/C28H22O5/c1-17(22-15-24(27(30)32-2)20-12-8-4-6-10-18(20)22)14-26(29)23-16-25(28(31)33-3)21-13-9-5-7-11-19(21)23/h4-16H,1-3H3/b17-14+