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

Systemtic Name: 4-azanyl-2-(4-morpholin-4-yl-3-nitro-phenyl)carbonyl-isoindole-1,3-dione Openeye Name: 4-amino-2-(4-morpholino-3-nitro-benzoyl)isoindoline-1,3-dione CAS Name: 4-amino-2-[[4-(4-morpholinyl)-3-nitrophenyl]-oxomethyl]isoindole-1,3-dione IUPAC Name: 4-amino-2-(4-morpholin-4-yl-3-nitrobenzoyl)isoindole-1,3-dione Traditional Name: 4-amino-2-(4-morpholino-3-nitro-benzoyl)isoindoline-1,3-quinone Formula: C19H16N4O6 MolecularWeight: 396.35354

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)C(=O)N3C(=O)C4=C(C3=O)C(=CC=C4)N)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)C(=O)N3C(=O)C4=C(C3=O)C(=CC=C4)N)[N+](=O)[O-]

InChI

InChI=1S/C19H16N4O6/c20-13-3-1-2-12-16(13)19(26)22(18(12)25)17(24)11-4-5-14(15(10-11)23(27)28)21-6-8-29-9-7-21/h1-5,10H,6-9,20H2