N-[4-chloranyl-3-(6-methyl-1,3-benzoxazol-2-yl)phenyl]-1-(6-nitro-1,3-benzodioxol-5-yl)methanimine

Systemtic Name: N-[4-chloranyl-3-(6-methyl-1,3-benzoxazol-2-yl)phenyl]-1-(6-nitro-1,3-benzodioxol-5-yl)methanimine Openeye Name: N-[4-chloro-3-(6-methyl-1,3-benzoxazol-2-yl)phenyl]-1-(6-nitro-1,3-benzodioxol-5-yl)methanimine CAS Name: N-[4-chloro-3-(6-methyl-1,3-benzoxazol-2-yl)phenyl]-1-(6-nitro-1,3-benzodioxol-5-yl)methanimine IUPAC Name: N-[4-chloro-3-(6-methyl-1,3-benzoxazol-2-yl)phenyl]-1-(6-nitro-1,3-benzodioxol-5-yl)methanimine Traditional Name: [4-chloro-3-(6-methyl-1,3-benzoxazol-2-yl)phenyl]-[(6-nitro-1,3-benzodioxol-5-yl)methylene]amine Formula: C22H14ClN3O5 MolecularWeight: 435.81666

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(O2)C3=C(C=CC(=C3)N=CC4=CC5=C(C=C4[N+](=O)[O-])OCO5)Cl

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(O2)C3=C(C=CC(=C3)N=CC4=CC5=C(C=C4[N+](=O)[O-])OCO5)Cl

InChI

InChI=1S/C22H14ClN3O5/c1-12-2-5-17-19(6-12)31-22(25-17)15-8-14(3-4-16(15)23)24-10-13-7-20-21(30-11-29-20)9-18(13)26(27)28/h2-10H,11H2,1H3