[4-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]phenyl] prop-2-enoate

Systemtic Name: [4-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]phenyl] prop-2-enoate Openeye Name: [4-(4-nitro-1,3-dioxo-isoindolin-2-yl)phenyl] prop-2-enoate CAS Name: 2-propenoic acid [4-(4-nitro-1,3-dioxo-2-isoindolyl)phenyl] ester IUPAC Name: [4-(4-nitro-1,3-dioxoisoindol-2-yl)phenyl] prop-2-enoate Traditional Name: acrylic acid [4-(1,3-diketo-4-nitro-isoindolin-2-yl)phenyl] ester Formula: C17H10N2O6 MolecularWeight: 338.2711

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CC(=O)OC1=CC=C(C=C1)N2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C=CC(=O)OC1=CC=C(C=C1)N2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H10N2O6/c1-2-14(20)25-11-8-6-10(7-9-11)18-16(21)12-4-3-5-13(19(23)24)15(12)17(18)22/h2-9H,1H2