(Z)-4-oxidanylidene-4-[[4-(4-phenylpiperazin-1-yl)phenyl]amino]but-2-enoic acid

Systemtic Name: (Z)-4-oxidanylidene-4-[[4-(4-phenylpiperazin-1-yl)phenyl]amino]but-2-enoic acid Openeye Name: (Z)-4-oxo-4-[4-(4-phenylpiperazin-1-yl)anilino]but-2-enoic acid CAS Name: (Z)-4-oxo-4-[4-(4-phenyl-1-piperazinyl)anilino]-2-butenoic acid IUPAC Name: (Z)-4-oxo-4-[4-(4-phenylpiperazin-1-yl)anilino]but-2-enoic acid Traditional Name: (Z)-4-keto-4-[4-(4-phenylpiperazino)anilino]but-2-enoic acid Formula: C20H21N3O3 MolecularWeight: 351.39904

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C3=CC=C(C=C3)NC(=O)C=CC(=O)O

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C3=CC=C(C=C3)NC(=O)/C=C\C(=O)O

InChI

InChI=1S/C20H21N3O3/c24-19(10-11-20(25)26)21-16-6-8-18(9-7-16)23-14-12-22(13-15-23)17-4-2-1-3-5-17/h1-11H,12-15H2,(H,21,24)(H,25,26)/b11-10-