3-chloranyl-N-[cyano-(4-phenylmethoxyphenyl)methyl]-N-(2-methylphenyl)propanamide

Systemtic Name: 3-chloranyl-N-[cyano-(4-phenylmethoxyphenyl)methyl]-N-(2-methylphenyl)propanamide Openeye Name: N-[(4-benzyloxyphenyl)-cyano-methyl]-3-chloro-N-(o-tolyl)propanamide CAS Name: 3-chloro-N-[cyano-(4-phenylmethoxyphenyl)methyl]-N-(2-methylphenyl)propanamide IUPAC Name: 3-chloro-N-[cyano-(4-phenylmethoxyphenyl)methyl]-N-(2-methylphenyl)propanamide Traditional Name: N-[(4-benzoxyphenyl)-cyano-methyl]-3-chloro-N-(o-tolyl)propionamide Formula: C25H23ClN2O2 MolecularWeight: 418.91532

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N(C(C#N)C2=CC=C(C=C2)OCC3=CC=CC=C3)C(=O)CCCl

Isomeric SMILES

CC1=CC=CC=C1N(C(C#N)C2=CC=C(C=C2)OCC3=CC=CC=C3)C(=O)CCCl

InChI

InChI=1S/C25H23ClN2O2/c1-19-7-5-6-10-23(19)28(25(29)15-16-26)24(17-27)21-11-13-22(14-12-21)30-18-20-8-3-2-4-9-20/h2-14,24H,15-16,18H2,1H3