[1,3-bis(oxidanylidene)isoindol-2-yl]methyl 4-(5-chloranylthiophen-2-yl)-4-oxidanylidene-butanoate

Systemtic Name: [1,3-bis(oxidanylidene)isoindol-2-yl]methyl 4-(5-chloranylthiophen-2-yl)-4-oxidanylidene-butanoate Openeye Name: (1,3-dioxoisoindolin-2-yl)methyl 4-(5-chloro-2-thienyl)-4-oxo-butanoate CAS Name: 4-(5-chloro-2-thiophenyl)-4-oxobutanoic acid (1,3-dioxo-2-isoindolyl)methyl ester IUPAC Name: (1,3-dioxoisoindol-2-yl)methyl 4-(5-chlorothiophen-2-yl)-4-oxobutanoate Traditional Name: 4-(5-chloro-2-thienyl)-4-keto-butyric acid phthalimidomethyl ester Formula: C17H12ClNO5S MolecularWeight: 377.79888

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)COC(=O)CCC(=O)C3=CC=C(S3)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)COC(=O)CCC(=O)C3=CC=C(S3)Cl

InChI

InChI=1S/C17H12ClNO5S/c18-14-7-6-13(25-14)12(20)5-8-15(21)24-9-19-16(22)10-3-1-2-4-11(10)17(19)23/h1-4,6-7H,5,8-9H2