4-azanyl-2-(3-methyl-4-nitro-phenyl)carbonyl-isoindole-1,3-dione

Systemtic Name: 4-azanyl-2-(3-methyl-4-nitro-phenyl)carbonyl-isoindole-1,3-dione Openeye Name: 4-amino-2-(3-methyl-4-nitro-benzoyl)isoindoline-1,3-dione CAS Name: 4-amino-2-[(3-methyl-4-nitrophenyl)-oxomethyl]isoindole-1,3-dione IUPAC Name: 4-amino-2-(3-methyl-4-nitrobenzoyl)isoindole-1,3-dione Traditional Name: 4-amino-2-(3-methyl-4-nitro-benzoyl)isoindoline-1,3-quinone Formula: C16H11N3O5 MolecularWeight: 325.27564

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)N2C(=O)C3=C(C2=O)C(=CC=C3)N)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)N2C(=O)C3=C(C2=O)C(=CC=C3)N)[N+](=O)[O-]

InChI

InChI=1S/C16H11N3O5/c1-8-7-9(5-6-12(8)19(23)24)14(20)18-15(21)10-3-2-4-11(17)13(10)16(18)22/h2-7H,17H2,1H3