methyl 3-[2-(3,5-dimethylphenoxy)ethanoylamino]-4-(4-ethylpiperazin-1-yl)benzoate

Systemtic Name: methyl 3-[2-(3,5-dimethylphenoxy)ethanoylamino]-4-(4-ethylpiperazin-1-yl)benzoate Openeye Name: methyl 3-[[2-(3,5-dimethylphenoxy)acetyl]amino]-4-(4-ethylpiperazin-1-yl)benzoate CAS Name: 3-[[2-(3,5-dimethylphenoxy)-1-oxoethyl]amino]-4-(4-ethyl-1-piperazinyl)benzoic acid methyl ester IUPAC Name: methyl 3-[[2-(3,5-dimethylphenoxy)acetyl]amino]-4-(4-ethylpiperazin-1-yl)benzoate Traditional Name: 3-[[2-(3,5-dimethylphenoxy)acetyl]amino]-4-(4-ethylpiperazino)benzoic acid methyl ester Formula: C24H31N3O4 MolecularWeight: 425.52064

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=C(C=C(C=C2)C(=O)OC)NC(=O)COC3=CC(=CC(=C3)C)C

Isomeric SMILES

CCN1CCN(CC1)C2=C(C=C(C=C2)C(=O)OC)NC(=O)COC3=CC(=CC(=C3)C)C

InChI

InChI=1S/C24H31N3O4/c1-5-26-8-10-27(11-9-26)22-7-6-19(24(29)30-4)15-21(22)25-23(28)16-31-20-13-17(2)12-18(3)14-20/h6-7,12-15H,5,8-11,16H2,1-4H3,(H,25,28)