N-[(E)-(4-methyl-3-phenyl-1,4-benzoxazin-2-yl)methylideneamino]-2,4-dinitro-aniline

Systemtic Name: N-[(E)-(4-methyl-3-phenyl-1,4-benzoxazin-2-yl)methylideneamino]-2,4-dinitro-aniline Openeye Name: N-[(E)-(4-methyl-3-phenyl-1,4-benzoxazin-2-yl)methyleneamino]-2,4-dinitro-aniline CAS Name: N-[(E)-(4-methyl-3-phenyl-1,4-benzoxazin-2-yl)methylideneamino]-2,4-dinitroaniline IUPAC Name: N-[(E)-(4-methyl-3-phenyl-1,4-benzoxazin-2-yl)methylideneamino]-2,4-dinitroaniline Traditional Name: (2,4-dinitrophenyl)-[(E)-(4-methyl-3-phenyl-1,4-benzoxazin-2-yl)methyleneamino]amine Formula: C22H17N5O5 MolecularWeight: 431.40088

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2OC(=C1C3=CC=CC=C3)C=NNC4=C(C=C(C=C4)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CN1C2=CC=CC=C2OC(=C1C3=CC=CC=C3)/C=N/NC4=C(C=C(C=C4)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C22H17N5O5/c1-25-18-9-5-6-10-20(18)32-21(22(25)15-7-3-2-4-8-15)14-23-24-17-12-11-16(26(28)29)13-19(17)27(30)31/h2-14,24H,1H3/b23-14+