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

Systemtic Name: 2,4-dinitro-N-[4-(3-phenylpropoxy)phenyl]aniline Openeye Name: 2,4-dinitro-N-[4-(3-phenylpropoxy)phenyl]aniline CAS Name: 2,4-dinitro-N-[4-(3-phenylpropoxy)phenyl]aniline IUPAC Name: 2,4-dinitro-N-[4-(3-phenylpropoxy)phenyl]aniline Traditional Name: (2,4-dinitrophenyl)-[4-(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=C(C=C2)NC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

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

InChI

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