2-[4-[3-[(2-azanyl-4-ethanoyl-phenyl)amino]phenyl]piperazin-1-yl]ethanoic acid

Systemtic Name: 2-[4-[3-[(2-azanyl-4-ethanoyl-phenyl)amino]phenyl]piperazin-1-yl]ethanoic acid Openeye Name: 2-[4-[3-(4-acetyl-2-amino-anilino)phenyl]piperazin-1-yl]acetic acid CAS Name: 2-[4-[3-(4-acetyl-2-aminoanilino)phenyl]-1-piperazinyl]acetic acid IUPAC Name: 2-[4-[3-(4-acetyl-2-aminoanilino)phenyl]piperazin-1-yl]acetic acid Traditional Name: 2-[4-[3-(4-acetyl-2-amino-anilino)phenyl]piperazino]acetic acid Formula: C20H24N4O3 MolecularWeight: 368.42956

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)NC2=CC=CC(=C2)N3CCN(CC3)CC(=O)O)N

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)NC2=CC=CC(=C2)N3CCN(CC3)CC(=O)O)N

InChI

InChI=1S/C20H24N4O3/c1-14(25)15-5-6-19(18(21)11-15)22-16-3-2-4-17(12-16)24-9-7-23(8-10-24)13-20(26)27/h2-6,11-12,22H,7-10,13,21H2,1H3,(H,26,27)