2,4-dinitro-N-[3-(3-phenylpropoxy)phenyl]aniline

Systemtic Name: 2,4-dinitro-N-[3-(3-phenylpropoxy)phenyl]aniline Openeye Name: 2,4-dinitro-N-[3-(3-phenylpropoxy)phenyl]aniline CAS Name: 2,4-dinitro-N-[3-(3-phenylpropoxy)phenyl]aniline IUPAC Name: 2,4-dinitro-N-[3-(3-phenylpropoxy)phenyl]aniline Traditional Name: (2,4-dinitrophenyl)-[3-(3-phenylpropoxy)phenyl]amine Formula: C21H19N3O5 MolecularWeight: 393.39266

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCOC2=CC=CC(=C2)NC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CCCOC2=CC=CC(=C2)NC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C21H19N3O5/c25-23(26)18-11-12-20(21(15-18)24(27)28)22-17-9-4-10-19(14-17)29-13-5-8-16-6-2-1-3-7-16/h1-4,6-7,9-12,14-15,22H,5,8,13H2