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

Systemtic Name: methyl 4-(4-methylpiperazin-1-yl)-3-[(3-phenylmethoxyphenyl)carbonylamino]benzoate Openeye Name: methyl 3-[(3-benzyloxybenzoyl)amino]-4-(4-methylpiperazin-1-yl)benzoate CAS Name: 4-(4-methyl-1-piperazinyl)-3-[[oxo-(3-phenylmethoxyphenyl)methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-(4-methylpiperazin-1-yl)-3-[(3-phenylmethoxybenzoyl)amino]benzoate Traditional Name: 3-[(3-benzoxybenzoyl)amino]-4-(4-methylpiperazino)benzoic acid methyl ester Formula: C27H29N3O4 MolecularWeight: 459.53686

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C(C=C(C=C2)C(=O)OC)NC(=O)C3=CC(=CC=C3)OCC4=CC=CC=C4

Isomeric SMILES

CN1CCN(CC1)C2=C(C=C(C=C2)C(=O)OC)NC(=O)C3=CC(=CC=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C27H29N3O4/c1-29-13-15-30(16-14-29)25-12-11-22(27(32)33-2)18-24(25)28-26(31)21-9-6-10-23(17-21)34-19-20-7-4-3-5-8-20/h3-12,17-18H,13-16,19H2,1-2H3,(H,28,31)