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

Systemtic Name: methyl 4-(4-ethylpiperazin-1-yl)-3-[(3-phenylmethoxyphenyl)carbonylamino]benzoate Openeye Name: methyl 3-[(3-benzyloxybenzoyl)amino]-4-(4-ethylpiperazin-1-yl)benzoate CAS Name: 4-(4-ethyl-1-piperazinyl)-3-[[oxo-(3-phenylmethoxyphenyl)methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-(4-ethylpiperazin-1-yl)-3-[(3-phenylmethoxybenzoyl)amino]benzoate Traditional Name: 3-[(3-benzoxybenzoyl)amino]-4-(4-ethylpiperazino)benzoic acid methyl ester Formula: C28H31N3O4 MolecularWeight: 473.56344

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=C(C=C(C=C2)C(=O)OC)NC(=O)C3=CC(=CC=C3)OCC4=CC=CC=C4

Isomeric SMILES

CCN1CCN(CC1)C2=C(C=C(C=C2)C(=O)OC)NC(=O)C3=CC(=CC=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C28H31N3O4/c1-3-30-14-16-31(17-15-30)26-13-12-23(28(33)34-2)19-25(26)29-27(32)22-10-7-11-24(18-22)35-20-21-8-5-4-6-9-21/h4-13,18-19H,3,14-17,20H2,1-2H3,(H,29,32)