methyl 4-[[[4-(4-phenylpiperazin-1-yl)phenyl]carbonylamino]carbamoyl]benzoate

Systemtic Name: methyl 4-[[[4-(4-phenylpiperazin-1-yl)phenyl]carbonylamino]carbamoyl]benzoate Openeye Name: methyl 4-[[[4-(4-phenylpiperazin-1-yl)benzoyl]amino]carbamoyl]benzoate CAS Name: 4-[oxo-[[oxo-[4-(4-phenyl-1-piperazinyl)phenyl]methyl]hydrazo]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[[4-(4-phenylpiperazin-1-yl)benzoyl]amino]carbamoyl]benzoate Traditional Name: 4-[[[4-(4-phenylpiperazino)benzoyl]amino]carbamoyl]benzoic acid methyl ester Formula: C26H26N4O4 MolecularWeight: 458.50904

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C(=O)NNC(=O)C2=CC=C(C=C2)N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C(=O)NNC(=O)C2=CC=C(C=C2)N3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C26H26N4O4/c1-34-26(33)21-9-7-19(8-10-21)24(31)27-28-25(32)20-11-13-23(14-12-20)30-17-15-29(16-18-30)22-5-3-2-4-6-22/h2-14H,15-18H2,1H3,(H,27,31)(H,28,32)