N-(4-butylphenyl)-2,4-dinitro-aniline

Systemtic Name: N-(4-butylphenyl)-2,4-dinitro-aniline Openeye Name: N-(4-butylphenyl)-2,4-dinitro-aniline CAS Name: N-(4-butylphenyl)-2,4-dinitroaniline IUPAC Name: N-(4-butylphenyl)-2,4-dinitroaniline Traditional Name: (4-butylphenyl)-(2,4-dinitrophenyl)amine Formula: C16H17N3O4 MolecularWeight: 315.32388

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C16H17N3O4/c1-2-3-4-12-5-7-13(8-6-12)17-15-10-9-14(18(20)21)11-16(15)19(22)23/h5-11,17H,2-4H2,1H3