4-[[4-[4-(4-fluorophenyl)piperazin-1-yl]phenyl]amino]-4-oxidanylidene-butanoate

Systemtic Name: 4-[[4-[4-(4-fluorophenyl)piperazin-1-yl]phenyl]amino]-4-oxidanylidene-butanoate Openeye Name: 4-[4-[4-(4-fluorophenyl)piperazin-1-yl]anilino]-4-oxo-butanoate CAS Name: 4-[4-[4-(4-fluorophenyl)-1-piperazinyl]anilino]-4-oxobutanoate IUPAC Name: 4-[4-[4-(4-fluorophenyl)piperazin-1-yl]anilino]-4-oxobutanoate Traditional Name: 4-[4-[4-(4-fluorophenyl)piperazino]anilino]-4-keto-butyrate Formula: C20H21FN3O3- MolecularWeight: 370.397443

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)NC(=O)CCC(=O)[O-])C3=CC=C(C=C3)F

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)NC(=O)CCC(=O)[O-])C3=CC=C(C=C3)F

InChI

InChI=1S/C20H22FN3O3/c21-15-1-5-17(6-2-15)23-11-13-24(14-12-23)18-7-3-16(4-8-18)22-19(25)9-10-20(26)27/h1-8H,9-14H2,(H,22,25)(H,26,27)/p-1