2-[(4E)-4-[(4-methoxy-2-nitro-phenyl)hydrazinylidene]butyl]isoindole-1,3-dione

Systemtic Name: 2-[(4E)-4-[(4-methoxy-2-nitro-phenyl)hydrazinylidene]butyl]isoindole-1,3-dione Openeye Name: 2-[(4E)-4-[(4-methoxy-2-nitro-phenyl)hydrazono]butyl]isoindoline-1,3-dione CAS Name: 2-[(4E)-4-[(4-methoxy-2-nitrophenyl)hydrazinylidene]butyl]isoindole-1,3-dione IUPAC Name: 2-[(4E)-4-[(4-methoxy-2-nitrophenyl)hydrazinylidene]butyl]isoindole-1,3-dione Traditional Name: 2-[(4E)-4-[(4-methoxy-2-nitro-phenyl)hydrazono]butyl]isoindoline-1,3-quinone Formula: C19H18N4O5 MolecularWeight: 382.37002

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NN=CCCCN2C(=O)C3=CC=CC=C3C2=O)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1)N/N=C/CCCN2C(=O)C3=CC=CC=C3C2=O)[N+](=O)[O-]

InChI

InChI=1S/C19H18N4O5/c1-28-13-8-9-16(17(12-13)23(26)27)21-20-10-4-5-11-22-18(24)14-6-2-3-7-15(14)19(22)25/h2-3,6-10,12,21H,4-5,11H2,1H3/b20-10+