N-[(E)-(4-nitrophenyl)methylideneamino]aniline hydrate

Systemtic Name: N-[(E)-(4-nitrophenyl)methylideneamino]aniline hydrate Openeye Name: N-[(E)-(4-nitrophenyl)methyleneamino]aniline hydrate CAS Name: N-[(E)-(4-nitrophenyl)methylideneamino]aniline hydrate IUPAC Name: N-[(E)-(4-nitrophenyl)methylideneamino]aniline hydrate Traditional Name: [(E)-(4-nitrobenzylidene)amino]-phenyl-amine hydrate Formula: C13H13N3O3 MolecularWeight: 259.26062

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NN=CC2=CC=C(C=C2)[N+](=O)[O-].O

Isomeric SMILES

C1=CC=C(C=C1)N/N=C/C2=CC=C(C=C2)[N+](=O)[O-].O

InChI

InChI=1S/C13H11N3O2.H2O/c17-16(18)13-8-6-11(7-9-13)10-14-15-12-4-2-1-3-5-12;/h1-10,15H;1H2/b14-10+;