methyl 4-(4-ethanoylpiperazin-1-yl)-3-[(4-phenylmethoxyphenyl)carbonylamino]benzoate

Systemtic Name: methyl 4-(4-ethanoylpiperazin-1-yl)-3-[(4-phenylmethoxyphenyl)carbonylamino]benzoate Openeye Name: methyl 4-(4-acetylpiperazin-1-yl)-3-[(4-benzyloxybenzoyl)amino]benzoate CAS Name: 4-(4-acetyl-1-piperazinyl)-3-[[oxo-(4-phenylmethoxyphenyl)methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-(4-acetylpiperazin-1-yl)-3-[(4-phenylmethoxybenzoyl)amino]benzoate Traditional Name: 4-(4-acetylpiperazino)-3-[(4-benzoxybenzoyl)amino]benzoic acid methyl ester Formula: C28H29N3O5 MolecularWeight: 487.54696

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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)C3=CC=C(C=C3)OCC4=CC=CC=C4

Isomeric SMILES

CC(=O)N1CCN(CC1)C2=C(C=C(C=C2)C(=O)OC)NC(=O)C3=CC=C(C=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C28H29N3O5/c1-20(32)30-14-16-31(17-15-30)26-13-10-23(28(34)35-2)18-25(26)29-27(33)22-8-11-24(12-9-22)36-19-21-6-4-3-5-7-21/h3-13,18H,14-17,19H2,1-2H3,(H,29,33)