[(1S)-2-oxidanylidenecyclohexyl] 5-[[1,3-bis(oxidanylidene)isoindol-2-yl]methyl]-2-methoxy-benzoate

Systemtic Name: [(1S)-2-oxidanylidenecyclohexyl] 5-[[1,3-bis(oxidanylidene)isoindol-2-yl]methyl]-2-methoxy-benzoate Openeye Name: [(1S)-2-oxocyclohexyl] 5-[(1,3-dioxoisoindolin-2-yl)methyl]-2-methoxy-benzoate CAS Name: 5-[(1,3-dioxo-2-isoindolyl)methyl]-2-methoxybenzoic acid [(1S)-2-oxocyclohexyl] ester IUPAC Name: [(1S)-2-oxocyclohexyl] 5-[(1,3-dioxoisoindol-2-yl)methyl]-2-methoxybenzoate Traditional Name: 2-methoxy-5-(phthalimidomethyl)benzoic acid [(1S)-2-ketocyclohexyl] ester Formula: C23H21NO6 MolecularWeight: 407.41594

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2C(=O)C3=CC=CC=C3C2=O)C(=O)OC4CCCCC4=O

Isomeric SMILES

COC1=C(C=C(C=C1)CN2C(=O)C3=CC=CC=C3C2=O)C(=O)O[C@H]4CCCCC4=O

InChI

InChI=1S/C23H21NO6/c1-29-19-11-10-14(12-17(19)23(28)30-20-9-5-4-8-18(20)25)13-24-21(26)15-6-2-3-7-16(15)22(24)27/h2-3,6-7,10-12,20H,4-5,8-9,13H2,1H3/t20-/m0/s1