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

Systemtic Name: methyl 2-[2-[1,3-bis(oxidanylidene)isoindol-2-yl]-1-ethoxycarbonyloxy-3-hexyl-azulen-6-yl]ethanoate Openeye Name: methyl 2-[2-(1,3-dioxoisoindolin-2-yl)-1-ethoxycarbonyloxy-3-hexyl-azulen-6-yl]acetate CAS Name: 2-[2-(1,3-dioxo-2-isoindolyl)-1-ethoxycarbonyloxy-3-hexyl-6-azulenyl]acetic acid methyl ester IUPAC Name: methyl 2-[2-(1,3-dioxoisoindol-2-yl)-1-ethoxycarbonyloxy-3-hexylazulen-6-yl]acetate Traditional Name: 2-(1-carbethoxyoxy-3-hexyl-2-phthalimido-azulen-6-yl)acetic acid methyl ester Formula: C30H31NO7 MolecularWeight: 517.56964

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C2C=CC(=CC=C2C(=C1N3C(=O)C4=CC=CC=C4C3=O)OC(=O)OCC)CC(=O)OC

Isomeric SMILES

CCCCCCC1=C2C=CC(=CC=C2C(=C1N3C(=O)C4=CC=CC=C4C3=O)OC(=O)OCC)CC(=O)OC

InChI

InChI=1S/C30H31NO7/c1-4-6-7-8-11-21-20-16-14-19(18-25(32)36-3)15-17-22(20)27(38-30(35)37-5-2)26(21)31-28(33)23-12-9-10-13-24(23)29(31)34/h9-10,12-17H,4-8,11,18H2,1-3H3