4-[(3-chloranyl-4-phenylmethoxy-phenyl)amino]-5-(3-nitrophenyl)pyridine-3-carbonitrile

Systemtic Name: 4-[(3-chloranyl-4-phenylmethoxy-phenyl)amino]-5-(3-nitrophenyl)pyridine-3-carbonitrile Openeye Name: 4-(4-benzyloxy-3-chloro-anilino)-5-(3-nitrophenyl)pyridine-3-carbonitrile CAS Name: 4-(3-chloro-4-phenylmethoxyanilino)-5-(3-nitrophenyl)-3-pyridinecarbonitrile IUPAC Name: 4-(3-chloro-4-phenylmethoxyanilino)-5-(3-nitrophenyl)pyridine-3-carbonitrile Traditional Name: 4-(4-benzoxy-3-chloro-anilino)-5-(3-nitrophenyl)nicotinonitrile Formula: C25H17ClN4O3 MolecularWeight: 456.88048

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=C(C=C(C=C2)NC3=C(C=NC=C3C#N)C4=CC(=CC=C4)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC=C(C=C1)COC2=C(C=C(C=C2)NC3=C(C=NC=C3C#N)C4=CC(=CC=C4)[N+](=O)[O-])Cl

InChI

InChI=1S/C25H17ClN4O3/c26-23-12-20(9-10-24(23)33-16-17-5-2-1-3-6-17)29-25-19(13-27)14-28-15-22(25)18-7-4-8-21(11-18)30(31)32/h1-12,14-15H,16H2,(H,28,29)