methyl 2-[11-[1,3-bis(oxidanylidene)isoindol-2-yl]undecanoylamino]benzoate

Systemtic Name: methyl 2-[11-[1,3-bis(oxidanylidene)isoindol-2-yl]undecanoylamino]benzoate Openeye Name: methyl 2-[11-(1,3-dioxoisoindolin-2-yl)undecanoylamino]benzoate CAS Name: 2-[[11-(1,3-dioxo-2-isoindolyl)-1-oxoundecyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[11-(1,3-dioxoisoindol-2-yl)undecanoylamino]benzoate Traditional Name: 2-(11-phthalimidoundecanoylamino)benzoic acid methyl ester Formula: C27H32N2O5 MolecularWeight: 464.55338

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NC(=O)CCCCCCCCCCN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

COC(=O)C1=CC=CC=C1NC(=O)CCCCCCCCCCN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C27H32N2O5/c1-34-27(33)22-16-11-12-17-23(22)28-24(30)18-8-6-4-2-3-5-7-13-19-29-25(31)20-14-9-10-15-21(20)26(29)32/h9-12,14-17H,2-8,13,18-19H2,1H3,(H,28,30)