N-[(E)-[4-(2-cyano-4-nitro-phenoxy)phenyl]methylideneamino]-2-pyrrol-1-yl-benzamide

Systemtic Name: N-[(E)-[4-(2-cyano-4-nitro-phenoxy)phenyl]methylideneamino]-2-pyrrol-1-yl-benzamide Openeye Name: N-[(E)-[4-(2-cyano-4-nitro-phenoxy)phenyl]methyleneamino]-2-pyrrol-1-yl-benzamide CAS Name: N-[(E)-[4-(2-cyano-4-nitrophenoxy)phenyl]methylideneamino]-2-(1-pyrrolyl)benzamide IUPAC Name: N-[(E)-[4-(2-cyano-4-nitrophenoxy)phenyl]methylideneamino]-2-pyrrol-1-ylbenzamide Traditional Name: N-[(E)-[4-(2-cyano-4-nitro-phenoxy)benzylidene]amino]-2-pyrrol-1-yl-benzamide Formula: C25H17N5O4 MolecularWeight: 451.43358

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NN=CC2=CC=C(C=C2)OC3=C(C=C(C=C3)[N+](=O)[O-])C#N)N4C=CC=C4

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)N/N=C/C2=CC=C(C=C2)OC3=C(C=C(C=C3)[N+](=O)[O-])C#N)N4C=CC=C4

InChI

InChI=1S/C25H17N5O4/c26-16-19-15-20(30(32)33)9-12-24(19)34-21-10-7-18(8-11-21)17-27-28-25(31)22-5-1-2-6-23(22)29-13-3-4-14-29/h1-15,17H,(H,28,31)/b27-17+