N-ethyl-4-nitro-2-(5-phenyl-1,3-benzoxazol-2-yl)aniline

Systemtic Name: N-ethyl-4-nitro-2-(5-phenyl-1,3-benzoxazol-2-yl)aniline Openeye Name: N-ethyl-4-nitro-2-(5-phenyl-1,3-benzoxazol-2-yl)aniline CAS Name: N-ethyl-4-nitro-2-(5-phenyl-1,3-benzoxazol-2-yl)aniline IUPAC Name: N-ethyl-4-nitro-2-(5-phenyl-1,3-benzoxazol-2-yl)aniline Traditional Name: ethyl-[4-nitro-2-(5-phenyl-1,3-benzoxazol-2-yl)phenyl]amine Formula: C21H17N3O3 MolecularWeight: 359.37798

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=C(C=C(C=C1)[N+](=O)[O-])C2=NC3=C(O2)C=CC(=C3)C4=CC=CC=C4

Isomeric SMILES

CCNC1=C(C=C(C=C1)[N+](=O)[O-])C2=NC3=C(O2)C=CC(=C3)C4=CC=CC=C4

InChI

InChI=1S/C21H17N3O3/c1-2-22-18-10-9-16(24(25)26)13-17(18)21-23-19-12-15(8-11-20(19)27-21)14-6-4-3-5-7-14/h3-13,22H,2H2,1H3