(E)-4-[4-chloranyl-3-(4-methylpiperazin-1-yl)phenoxy]-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (E)-4-[4-chloranyl-3-(4-methylpiperazin-1-yl)phenoxy]-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-[4-chloro-3-(4-methylpiperazin-1-yl)phenoxy]-4-oxo-but-2-enoic acid CAS Name: (E)-4-[4-chloro-3-(4-methyl-1-piperazinyl)phenoxy]-4-oxo-2-butenoic acid IUPAC Name: (E)-4-[4-chloro-3-(4-methylpiperazin-1-yl)phenoxy]-4-oxobut-2-enoic acid Traditional Name: (E)-4-[4-chloro-3-(4-methylpiperazino)phenoxy]-4-keto-but-2-enoic acid Formula: C15H17ClN2O4 MolecularWeight: 324.75948

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C(C=CC(=C2)OC(=O)C=CC(=O)O)Cl

Isomeric SMILES

CN1CCN(CC1)C2=C(C=CC(=C2)OC(=O)/C=C/C(=O)O)Cl

InChI

InChI=1S/C15H17ClN2O4/c1-17-6-8-18(9-7-17)13-10-11(2-3-12(13)16)22-15(21)5-4-14(19)20/h2-5,10H,6-9H2,1H3,(H,19,20)/b5-4+