methyl 2-[2-[1,3-bis(oxidanylidene)isoindol-2-yl]-1-butyl-3-ethoxycarbonyloxy-azulen-6-yl]ethanoate

Systemtic Name: methyl 2-[2-[1,3-bis(oxidanylidene)isoindol-2-yl]-1-butyl-3-ethoxycarbonyloxy-azulen-6-yl]ethanoate Openeye Name: methyl 2-[1-butyl-2-(1,3-dioxoisoindolin-2-yl)-3-ethoxycarbonyloxy-azulen-6-yl]acetate CAS Name: 2-[1-butyl-2-(1,3-dioxo-2-isoindolyl)-3-ethoxycarbonyloxy-6-azulenyl]acetic acid methyl ester IUPAC Name: methyl 2-[1-butyl-2-(1,3-dioxoisoindol-2-yl)-3-ethoxycarbonyloxyazulen-6-yl]acetate Traditional Name: 2-(1-butyl-3-carbethoxyoxy-2-phthalimido-azulen-6-yl)acetic acid methyl ester Formula: C28H27NO7 MolecularWeight: 489.51648

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C2C=CC(=CC=C2C(=C1N3C(=O)C4=CC=CC=C4C3=O)OC(=O)OCC)CC(=O)OC

Isomeric SMILES

CCCCC1=C2C=CC(=CC=C2C(=C1N3C(=O)C4=CC=CC=C4C3=O)OC(=O)OCC)CC(=O)OC

InChI

InChI=1S/C28H27NO7/c1-4-6-9-19-18-14-12-17(16-23(30)34-3)13-15-20(18)25(36-28(33)35-5-2)24(19)29-26(31)21-10-7-8-11-22(21)27(29)32/h7-8,10-15H,4-6,9,16H2,1-3H3