3-chloranyl-N-[cyano-(2-phenylmethoxyphenyl)methyl]-N-(3-nitrophenyl)propanamide

Systemtic Name: 3-chloranyl-N-[cyano-(2-phenylmethoxyphenyl)methyl]-N-(3-nitrophenyl)propanamide Openeye Name: N-[(2-benzyloxyphenyl)-cyano-methyl]-3-chloro-N-(3-nitrophenyl)propanamide CAS Name: 3-chloro-N-[cyano-(2-phenylmethoxyphenyl)methyl]-N-(3-nitrophenyl)propanamide IUPAC Name: 3-chloro-N-[cyano-(2-phenylmethoxyphenyl)methyl]-N-(3-nitrophenyl)propanamide Traditional Name: N-[(2-benzoxyphenyl)-cyano-methyl]-3-chloro-N-(3-nitrophenyl)propionamide Formula: C24H20ClN3O4 MolecularWeight: 449.8863

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=CC=C2C(C#N)N(C3=CC(=CC=C3)[N+](=O)[O-])C(=O)CCCl

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=CC=C2C(C#N)N(C3=CC(=CC=C3)[N+](=O)[O-])C(=O)CCCl

InChI

InChI=1S/C24H20ClN3O4/c25-14-13-24(29)27(19-9-6-10-20(15-19)28(30)31)22(16-26)21-11-4-5-12-23(21)32-17-18-7-2-1-3-8-18/h1-12,15,22H,13-14,17H2