1-[2-[2-(3,4-dimethoxyphenyl)ethanoylamino]ethyl]-N-phenyl-1,2,3-triazole-4-carboxamide

Systemtic Name: 1-[2-[2-(3,4-dimethoxyphenyl)ethanoylamino]ethyl]-N-phenyl-1,2,3-triazole-4-carboxamide Openeye Name: 1-[2-[[2-(3,4-dimethoxyphenyl)acetyl]amino]ethyl]-N-phenyl-triazole-4-carboxamide CAS Name: 1-[2-[[2-(3,4-dimethoxyphenyl)-1-oxoethyl]amino]ethyl]-N-phenyl-4-triazolecarboxamide IUPAC Name: 1-[2-[[2-(3,4-dimethoxyphenyl)acetyl]amino]ethyl]-N-phenyltriazole-4-carboxamide Traditional Name: 1-[2-(homoveratroylamino)ethyl]-N-phenyl-triazole-4-carboxamide Formula: C21H23N5O4 MolecularWeight: 409.43842

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC(=O)NCCN2C=C(N=N2)C(=O)NC3=CC=CC=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CC(=O)NCCN2C=C(N=N2)C(=O)NC3=CC=CC=C3)OC

InChI

InChI=1S/C21H23N5O4/c1-29-18-9-8-15(12-19(18)30-2)13-20(27)22-10-11-26-14-17(24-25-26)21(28)23-16-6-4-3-5-7-16/h3-9,12,14H,10-11,13H2,1-2H3,(H,22,27)(H,23,28)