3-[[[(E)-3-(3-chloranyl-4,5-dimethoxy-phenyl)prop-2-enoyl]amino]methyl]-N-phenyl-benzamide

Systemtic Name: 3-[[[(E)-3-(3-chloranyl-4,5-dimethoxy-phenyl)prop-2-enoyl]amino]methyl]-N-phenyl-benzamide Openeye Name: 3-[[[(E)-3-(3-chloro-4,5-dimethoxy-phenyl)prop-2-enoyl]amino]methyl]-N-phenyl-benzamide CAS Name: 3-[[[(E)-3-(3-chloro-4,5-dimethoxyphenyl)-1-oxoprop-2-enyl]amino]methyl]-N-phenylbenzamide IUPAC Name: 3-[[[(E)-3-(3-chloro-4,5-dimethoxyphenyl)prop-2-enoyl]amino]methyl]-N-phenylbenzamide Traditional Name: 3-[[[(E)-3-(3-chloro-4,5-dimethoxy-phenyl)acryloyl]amino]methyl]-N-phenyl-benzamide Formula: C25H23ClN2O4 MolecularWeight: 450.91412

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=CC(=O)NCC2=CC=CC(=C2)C(=O)NC3=CC=CC=C3)Cl)OC

Isomeric SMILES

COC1=C(C(=CC(=C1)/C=C/C(=O)NCC2=CC=CC(=C2)C(=O)NC3=CC=CC=C3)Cl)OC

InChI

InChI=1S/C25H23ClN2O4/c1-31-22-15-17(14-21(26)24(22)32-2)11-12-23(29)27-16-18-7-6-8-19(13-18)25(30)28-20-9-4-3-5-10-20/h3-15H,16H2,1-2H3,(H,27,29)(H,28,30)/b12-11+