methyl 3-[[2-(4-chloranylphenoxy)-2-methyl-propanoyl]amino]-4-(4-ethanoylpiperazin-1-yl)benzoate

Systemtic Name: methyl 3-[[2-(4-chloranylphenoxy)-2-methyl-propanoyl]amino]-4-(4-ethanoylpiperazin-1-yl)benzoate Openeye Name: methyl 4-(4-acetylpiperazin-1-yl)-3-[[2-(4-chlorophenoxy)-2-methyl-propanoyl]amino]benzoate CAS Name: 4-(4-acetyl-1-piperazinyl)-3-[[2-(4-chlorophenoxy)-2-methyl-1-oxopropyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-(4-acetylpiperazin-1-yl)-3-[[2-(4-chlorophenoxy)-2-methylpropanoyl]amino]benzoate Traditional Name: 4-(4-acetylpiperazino)-3-[[2-(4-chlorophenoxy)-2-methyl-propanoyl]amino]benzoic acid methyl ester Formula: C24H28ClN3O5 MolecularWeight: 473.94922

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C2=C(C=C(C=C2)C(=O)OC)NC(=O)C(C)(C)OC3=CC=C(C=C3)Cl

Isomeric SMILES

CC(=O)N1CCN(CC1)C2=C(C=C(C=C2)C(=O)OC)NC(=O)C(C)(C)OC3=CC=C(C=C3)Cl

InChI

InChI=1S/C24H28ClN3O5/c1-16(29)27-11-13-28(14-12-27)21-10-5-17(22(30)32-4)15-20(21)26-23(31)24(2,3)33-19-8-6-18(25)7-9-19/h5-10,15H,11-14H2,1-4H3,(H,26,31)