N-[1-(3-bromanyl-4-methoxy-phenyl)ethyl]-2-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]ethanamide

Systemtic Name: N-[1-(3-bromanyl-4-methoxy-phenyl)ethyl]-2-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]ethanamide Openeye Name: N-[1-(3-bromo-4-methoxy-phenyl)ethyl]-2-(4-nitro-1,3-dioxo-isoindolin-2-yl)acetamide CAS Name: N-[1-(3-bromo-4-methoxyphenyl)ethyl]-2-(4-nitro-1,3-dioxo-2-isoindolyl)acetamide IUPAC Name: N-[1-(3-bromo-4-methoxyphenyl)ethyl]-2-(4-nitro-1,3-dioxoisoindol-2-yl)acetamide Traditional Name: N-[1-(3-bromo-4-methoxy-phenyl)ethyl]-2-(1,3-diketo-4-nitro-isoindolin-2-yl)acetamide Formula: C19H16BrN3O6 MolecularWeight: 462.25084

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=C(C=C1)OC)Br)NC(=O)CN2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C1=CC(=C(C=C1)OC)Br)NC(=O)CN2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H16BrN3O6/c1-10(11-6-7-15(29-2)13(20)8-11)21-16(24)9-22-18(25)12-4-3-5-14(23(27)28)17(12)19(22)26/h3-8,10H,9H2,1-2H3,(H,21,24)