3-methoxy-2-[2-(4-phenylpiperazin-1-yl)ethylamino]benzoic acid

Systemtic Name: 3-methoxy-2-[2-(4-phenylpiperazin-1-yl)ethylamino]benzoic acid Openeye Name: 3-methoxy-2-[2-(4-phenylpiperazin-1-yl)ethylamino]benzoic acid CAS Name: 3-methoxy-2-[2-(4-phenyl-1-piperazinyl)ethylamino]benzoic acid IUPAC Name: 3-methoxy-2-[2-(4-phenylpiperazin-1-yl)ethylamino]benzoic acid Traditional Name: 3-methoxy-2-[2-(4-phenylpiperazino)ethylamino]benzoic acid Formula: C20H25N3O3 MolecularWeight: 355.4308

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1NCCN2CCN(CC2)C3=CC=CC=C3)C(=O)O

Isomeric SMILES

COC1=CC=CC(=C1NCCN2CCN(CC2)C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C20H25N3O3/c1-26-18-9-5-8-17(20(24)25)19(18)21-10-11-22-12-14-23(15-13-22)16-6-3-2-4-7-16/h2-9,21H,10-15H2,1H3,(H,24,25)