tert-butyl 3-oxidanylidene-2-[3-[(3,4,5-trimethoxyphenyl)carbonylamino]isoindol-1-ylidene]butanoate

Systemtic Name: tert-butyl 3-oxidanylidene-2-[3-[(3,4,5-trimethoxyphenyl)carbonylamino]isoindol-1-ylidene]butanoate Openeye Name: tert-butyl 3-oxo-2-[3-[(3,4,5-trimethoxybenzoyl)amino]isoindol-1-ylidene]butanoate CAS Name: 3-oxo-2-[3-[[oxo-(3,4,5-trimethoxyphenyl)methyl]amino]-1-isoindolylidene]butanoic acid tert-butyl ester IUPAC Name: tert-butyl 3-oxo-2-[3-[(3,4,5-trimethoxybenzoyl)amino]isoindol-1-ylidene]butanoate Traditional Name: 3-keto-2-[3-[(3,4,5-trimethoxybenzoyl)amino]isoindol-1-ylidene]butyric acid tert-butyl ester Formula: C26H28N2O7 MolecularWeight: 480.50972

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=C1C2=CC=CC=C2C(=N1)NC(=O)C3=CC(=C(C(=C3)OC)OC)OC)C(=O)OC(C)(C)C

Isomeric SMILES

CC(=O)C(=C1C2=CC=CC=C2C(=N1)NC(=O)C3=CC(=C(C(=C3)OC)OC)OC)C(=O)OC(C)(C)C

InChI

InChI=1S/C26H28N2O7/c1-14(29)20(25(31)35-26(2,3)4)21-16-10-8-9-11-17(16)23(27-21)28-24(30)15-12-18(32-5)22(34-7)19(13-15)33-6/h8-13H,1-7H3,(H,27,28,30)