4-(4-methylpiperazin-1-yl)-2-(phenethylamino)benzoic acid

Systemtic Name: 4-(4-methylpiperazin-1-yl)-2-(phenethylamino)benzoic acid Openeye Name: 4-(4-methylpiperazin-1-yl)-2-(phenethylamino)benzoic acid CAS Name: 4-(4-methyl-1-piperazinyl)-2-(phenethylamino)benzoic acid IUPAC Name: 4-(4-methylpiperazin-1-yl)-2-(phenethylamino)benzoic acid Traditional Name: 4-(4-methylpiperazino)-2-(phenethylamino)benzoic acid Formula: C20H25N3O2 MolecularWeight: 339.4314

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=CC(=C(C=C2)C(=O)O)NCCC3=CC=CC=C3

Isomeric SMILES

CN1CCN(CC1)C2=CC(=C(C=C2)C(=O)O)NCCC3=CC=CC=C3

InChI

InChI=1S/C20H25N3O2/c1-22-11-13-23(14-12-22)17-7-8-18(20(24)25)19(15-17)21-10-9-16-5-3-2-4-6-16/h2-8,15,21H,9-14H2,1H3,(H,24,25)