[2-bromanyl-6-methoxy-4-(2-nitroethenyl)phenyl] 2-[1,3-bis(oxidanylidene)isoindol-2-yl]-4-methyl-pentanoate

Systemtic Name: [2-bromanyl-6-methoxy-4-(2-nitroethenyl)phenyl] 2-[1,3-bis(oxidanylidene)isoindol-2-yl]-4-methyl-pentanoate Openeye Name: [2-bromo-6-methoxy-4-(2-nitrovinyl)phenyl] 2-(1,3-dioxoisoindolin-2-yl)-4-methyl-pentanoate CAS Name: 2-(1,3-dioxo-2-isoindolyl)-4-methylpentanoic acid [2-bromo-6-methoxy-4-(2-nitroethenyl)phenyl] ester IUPAC Name: [2-bromo-6-methoxy-4-(2-nitroethenyl)phenyl] 2-(1,3-dioxoisoindol-2-yl)-4-methylpentanoate Traditional Name: 4-methyl-2-phthalimido-valeric acid [2-bromo-6-methoxy-4-(2-nitrovinyl)phenyl] ester Formula: C23H21BrN2O7 MolecularWeight: 517.32604

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OC1=C(C=C(C=C1Br)C=C[N+](=O)[O-])OC)N2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CC(C)CC(C(=O)OC1=C(C=C(C=C1Br)C=C[N+](=O)[O-])OC)N2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C23H21BrN2O7/c1-13(2)10-18(26-21(27)15-6-4-5-7-16(15)22(26)28)23(29)33-20-17(24)11-14(8-9-25(30)31)12-19(20)32-3/h4-9,11-13,18H,10H2,1-3H3