4-(2-methyl-5-phenyl-pyrrol-1-yl)-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]benzamide

Systemtic Name: 4-(2-methyl-5-phenyl-pyrrol-1-yl)-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]benzamide Openeye Name: 4-(2-methyl-5-phenyl-pyrrol-1-yl)-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]benzamide CAS Name: 4-(2-methyl-5-phenyl-1-pyrrolyl)-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]benzamide IUPAC Name: 4-(2-methyl-5-phenylpyrrol-1-yl)-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]benzamide Traditional Name: 4-(2-methyl-5-phenyl-pyrrol-1-yl)-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]benzamide Formula: C26H20N4O5 MolecularWeight: 468.4608

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1C2=CC=C(C=C2)C(=O)NN=CC3=CC4=C(C=C3[N+](=O)[O-])OCO4)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(N1C2=CC=C(C=C2)C(=O)N/N=C/C3=CC4=C(C=C3[N+](=O)[O-])OCO4)C5=CC=CC=C5

InChI

InChI=1S/C26H20N4O5/c1-17-7-12-22(18-5-3-2-4-6-18)29(17)21-10-8-19(9-11-21)26(31)28-27-15-20-13-24-25(35-16-34-24)14-23(20)30(32)33/h2-15H,16H2,1H3,(H,28,31)/b27-15+