2-[phenylcarbonyl-[4-[(4-piperazin-1-ylphenyl)carbonylamino]phenyl]amino]ethanoic acid

Systemtic Name: 2-[phenylcarbonyl-[4-[(4-piperazin-1-ylphenyl)carbonylamino]phenyl]amino]ethanoic acid Openeye Name: 2-[N-benzoyl-4-[(4-piperazin-1-ylbenzoyl)amino]anilino]acetic acid CAS Name: 2-[N-benzoyl-4-[[oxo-[4-(1-piperazinyl)phenyl]methyl]amino]anilino]acetic acid IUPAC Name: 2-[N-benzoyl-4-[(4-piperazin-1-ylbenzoyl)amino]anilino]acetic acid Traditional Name: 2-[N-benzoyl-4-[(4-piperazinobenzoyl)amino]anilino]acetic acid Formula: C26H26N4O4 MolecularWeight: 458.50904

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)N(CC(=O)O)C(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1)C2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)N(CC(=O)O)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C26H26N4O4/c31-24(32)18-30(26(34)20-4-2-1-3-5-20)23-12-8-21(9-13-23)28-25(33)19-6-10-22(11-7-19)29-16-14-27-15-17-29/h1-13,27H,14-18H2,(H,28,33)(H,31,32)