N-(3,4-dichlorophenyl)-3-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]propanamide

Systemtic Name: N-(3,4-dichlorophenyl)-3-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]propanamide Openeye Name: N-(3,4-dichlorophenyl)-3-(4-nitro-1,3-dioxo-isoindolin-2-yl)propanamide CAS Name: N-(3,4-dichlorophenyl)-3-(4-nitro-1,3-dioxo-2-isoindolyl)propanamide IUPAC Name: N-(3,4-dichlorophenyl)-3-(4-nitro-1,3-dioxoisoindol-2-yl)propanamide Traditional Name: N-(3,4-dichlorophenyl)-3-(1,3-diketo-4-nitro-isoindolin-2-yl)propionamide Formula: C17H11Cl2N3O5 MolecularWeight: 408.19234

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)[N+](=O)[O-])C(=O)N(C2=O)CCC(=O)NC3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

C1=CC2=C(C(=C1)[N+](=O)[O-])C(=O)N(C2=O)CCC(=O)NC3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C17H11Cl2N3O5/c18-11-5-4-9(8-12(11)19)20-14(23)6-7-21-16(24)10-2-1-3-13(22(26)27)15(10)17(21)25/h1-5,8H,6-7H2,(H,20,23)