decyl 3-[(3,5-dinitrophenyl)amino]benzoate

Systemtic Name: decyl 3-[(3,5-dinitrophenyl)amino]benzoate Openeye Name: decyl 3-(3,5-dinitroanilino)benzoate CAS Name: 3-(3,5-dinitroanilino)benzoic acid decyl ester IUPAC Name: decyl 3-(3,5-dinitroanilino)benzoate Traditional Name: 3-(3,5-dinitroanilino)benzoic acid decyl ester Formula: C23H29N3O6 MolecularWeight: 443.49286

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC(=O)C1=CC(=CC=C1)NC2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCCCCCCCCCOC(=O)C1=CC(=CC=C1)NC2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C23H29N3O6/c1-2-3-4-5-6-7-8-9-13-32-23(27)18-11-10-12-19(14-18)24-20-15-21(25(28)29)17-22(16-20)26(30)31/h10-12,14-17,24H,2-9,13H2,1H3