cyclohexyl 2-[(1-oxidanylidene-3,4-dihydroisochromen-3-yl)carbonylamino]benzoate

Systemtic Name: cyclohexyl 2-[(1-oxidanylidene-3,4-dihydroisochromen-3-yl)carbonylamino]benzoate Openeye Name: cyclohexyl 2-[(1-oxoisochromane-3-carbonyl)amino]benzoate CAS Name: 2-[[oxo-(1-oxo-3,4-dihydro-1H-2-benzopyran-3-yl)methyl]amino]benzoic acid cyclohexyl ester IUPAC Name: cyclohexyl 2-[(1-oxo-3,4-dihydroisochromene-3-carbonyl)amino]benzoate Traditional Name: 2-[(1-ketoisochroman-3-carbonyl)amino]benzoic acid cyclohexyl ester Formula: C23H23NO5 MolecularWeight: 393.43242

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)OC(=O)C2=CC=CC=C2NC(=O)C3CC4=CC=CC=C4C(=O)O3

Isomeric SMILES

C1CCC(CC1)OC(=O)C2=CC=CC=C2NC(=O)C3CC4=CC=CC=C4C(=O)O3

InChI

InChI=1S/C23H23NO5/c25-21(20-14-15-8-4-5-11-17(15)22(26)29-20)24-19-13-7-6-12-18(19)23(27)28-16-9-2-1-3-10-16/h4-8,11-13,16,20H,1-3,9-10,14H2,(H,24,25)