4-[3-[1,3-bis(oxidanylidene)isoindol-2-yl]propoxy]-3-chloranyl-benzenecarbonitrile

Systemtic Name: 4-[3-[1,3-bis(oxidanylidene)isoindol-2-yl]propoxy]-3-chloranyl-benzenecarbonitrile Openeye Name: 3-chloro-4-[3-(1,3-dioxoisoindolin-2-yl)propoxy]benzonitrile CAS Name: 3-chloro-4-[3-(1,3-dioxo-2-isoindolyl)propoxy]benzonitrile IUPAC Name: 3-chloro-4-[3-(1,3-dioxoisoindol-2-yl)propoxy]benzonitrile Traditional Name: 3-chloro-4-(3-phthalimidopropoxy)benzonitrile Formula: C18H13ClN2O3 MolecularWeight: 340.76042

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCOC3=C(C=C(C=C3)C#N)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCOC3=C(C=C(C=C3)C#N)Cl

InChI

InChI=1S/C18H13ClN2O3/c19-15-10-12(11-20)6-7-16(15)24-9-3-8-21-17(22)13-4-1-2-5-14(13)18(21)23/h1-2,4-7,10H,3,8-9H2