4-[(3-hydroxyphenyl)amino]-2-(4-methylpiperazin-1-yl)-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[(3-hydroxyphenyl)amino]-2-(4-methylpiperazin-1-yl)-4-oxidanylidene-butanoic acid Openeye Name: 4-(3-hydroxyanilino)-2-(4-methylpiperazin-1-yl)-4-oxo-butanoic acid CAS Name: 4-(3-hydroxyanilino)-2-(4-methyl-1-piperazinyl)-4-oxobutanoic acid IUPAC Name: 4-(3-hydroxyanilino)-2-(4-methylpiperazin-1-yl)-4-oxobutanoic acid Traditional Name: 4-(3-hydroxyanilino)-4-keto-2-(4-methylpiperazino)butyric acid Formula: C15H21N3O4 MolecularWeight: 307.34494

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(CC(=O)NC2=CC(=CC=C2)O)C(=O)O

Isomeric SMILES

CN1CCN(CC1)C(CC(=O)NC2=CC(=CC=C2)O)C(=O)O

InChI

InChI=1S/C15H21N3O4/c1-17-5-7-18(8-6-17)13(15(21)22)10-14(20)16-11-3-2-4-12(19)9-11/h2-4,9,13,19H,5-8,10H2,1H3,(H,16,20)(H,21,22)