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

Systemtic Name: 2-[ethanoyl-[4-[(4-piperazin-1-ylphenyl)carbonylamino]phenyl]amino]ethanoic acid Openeye Name: 2-[N-acetyl-4-[(4-piperazin-1-ylbenzoyl)amino]anilino]acetic acid CAS Name: 2-[N-acetyl-4-[[oxo-[4-(1-piperazinyl)phenyl]methyl]amino]anilino]acetic acid IUPAC Name: 2-[N-acetyl-4-[(4-piperazin-1-ylbenzoyl)amino]anilino]acetic acid Traditional Name: 2-[N-acetyl-4-[(4-piperazinobenzoyl)amino]anilino]acetic acid Formula: C21H24N4O4 MolecularWeight: 396.43966

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(CC(=O)O)C1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)N3CCNCC3

Isomeric SMILES

CC(=O)N(CC(=O)O)C1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)N3CCNCC3

InChI

InChI=1S/C21H24N4O4/c1-15(26)25(14-20(27)28)19-8-4-17(5-9-19)23-21(29)16-2-6-18(7-3-16)24-12-10-22-11-13-24/h2-9,22H,10-14H2,1H3,(H,23,29)(H,27,28)