N-[(4-chlorophenyl)methyl]-3-[2-(3,5-dimethoxyphenyl)carbonylhydrazinyl]but-3-enamide

Systemtic Name: N-[(4-chlorophenyl)methyl]-3-[2-(3,5-dimethoxyphenyl)carbonylhydrazinyl]but-3-enamide Openeye Name: N-[(4-chlorophenyl)methyl]-3-[2-(3,5-dimethoxybenzoyl)hydrazino]but-3-enamide CAS Name: N-[(4-chlorophenyl)methyl]-3-[[(3,5-dimethoxyphenyl)-oxomethyl]hydrazo]-3-butenamide IUPAC Name: N-[(4-chlorophenyl)methyl]-3-[2-(3,5-dimethoxybenzoyl)hydrazinyl]but-3-enamide Traditional Name: N-(4-chlorobenzyl)-3-[N'-(3,5-dimethoxybenzoyl)hydrazino]but-3-enamide Formula: C20H22ClN3O4 MolecularWeight: 403.85938

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22ClN3O4/c1-13(8-19(25)22-12-14-4-6-16(21)7-5-14)23-24-20(26)15-9-17(27-2)11-18(10-15)28-3/h4-7,9-11,23H,1,8,12H2,2-3H3,(H,22,25)(H,24,26)