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

Systemtic Name: methyl 2-[2-[1,3-bis(oxidanylidene)isoindol-2-yl]-1-ethoxycarbonyloxy-3-pentyl-azulen-6-yl]ethanoate Openeye Name: methyl 2-[2-(1,3-dioxoisoindolin-2-yl)-1-ethoxycarbonyloxy-3-pentyl-azulen-6-yl]acetate CAS Name: 2-[2-(1,3-dioxo-2-isoindolyl)-1-ethoxycarbonyloxy-3-pentyl-6-azulenyl]acetic acid methyl ester IUPAC Name: methyl 2-[2-(1,3-dioxoisoindol-2-yl)-1-ethoxycarbonyloxy-3-pentylazulen-6-yl]acetate Traditional Name: 2-(1-amyl-3-carbethoxyoxy-2-phthalimido-azulen-6-yl)acetic acid methyl ester Formula: C29H29NO7 MolecularWeight: 503.54306

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C2C=CC(=CC=C2C(=C1N3C(=O)C4=CC=CC=C4C3=O)OC(=O)OCC)CC(=O)OC

Isomeric SMILES

CCCCCC1=C2C=CC(=CC=C2C(=C1N3C(=O)C4=CC=CC=C4C3=O)OC(=O)OCC)CC(=O)OC

InChI

InChI=1S/C29H29NO7/c1-4-6-7-10-20-19-15-13-18(17-24(31)35-3)14-16-21(19)26(37-29(34)36-5-2)25(20)30-27(32)22-11-8-9-12-23(22)28(30)33/h8-9,11-16H,4-7,10,17H2,1-3H3