4-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-[5-chloranyl-2-(4-methylphenyl)carbonyl-1-benzofuran-3-yl]butanamide

Systemtic Name: 4-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-[5-chloranyl-2-(4-methylphenyl)carbonyl-1-benzofuran-3-yl]butanamide Openeye Name: N-[5-chloro-2-(4-methylbenzoyl)benzofuran-3-yl]-4-(1,3-dioxoisoindolin-2-yl)butanamide CAS Name: N-[5-chloro-2-[(4-methylphenyl)-oxomethyl]-3-benzofuranyl]-4-(1,3-dioxo-2-isoindolyl)butanamide IUPAC Name: N-[5-chloro-2-(4-methylbenzoyl)-1-benzofuran-3-yl]-4-(1,3-dioxoisoindol-2-yl)butanamide Traditional Name: N-(5-chloro-2-p-toluoyl-benzofuran-3-yl)-4-phthalimido-butyramide Formula: C28H21ClN2O5 MolecularWeight: 500.92974

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C2=C(C3=C(O2)C=CC(=C3)Cl)NC(=O)CCCN4C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C2=C(C3=C(O2)C=CC(=C3)Cl)NC(=O)CCCN4C(=O)C5=CC=CC=C5C4=O

InChI

InChI=1S/C28H21ClN2O5/c1-16-8-10-17(11-9-16)25(33)26-24(21-15-18(29)12-13-22(21)36-26)30-23(32)7-4-14-31-27(34)19-5-2-3-6-20(19)28(31)35/h2-3,5-6,8-13,15H,4,7,14H2,1H3,(H,30,32)