methyl 4-(4-ethylpiperazin-1-yl)-3-[2-(3-methylphenoxy)ethanoylamino]benzoate

Systemtic Name: methyl 4-(4-ethylpiperazin-1-yl)-3-[2-(3-methylphenoxy)ethanoylamino]benzoate Openeye Name: methyl 4-(4-ethylpiperazin-1-yl)-3-[[2-(3-methylphenoxy)acetyl]amino]benzoate CAS Name: 4-(4-ethyl-1-piperazinyl)-3-[[2-(3-methylphenoxy)-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-(4-ethylpiperazin-1-yl)-3-[[2-(3-methylphenoxy)acetyl]amino]benzoate Traditional Name: 4-(4-ethylpiperazino)-3-[[2-(3-methylphenoxy)acetyl]amino]benzoic acid methyl ester Formula: C23H29N3O4 MolecularWeight: 411.49406

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H29N3O4/c1-4-25-10-12-26(13-11-25)21-9-8-18(23(28)29-3)15-20(21)24-22(27)16-30-19-7-5-6-17(2)14-19/h5-9,14-15H,4,10-13,16H2,1-3H3,(H,24,27)