(Z)-4-oxidanylidene-2-phenyl-4-[4-(4-propylphenyl)piperazin-1-yl]but-2-enoic acid

Systemtic Name: (Z)-4-oxidanylidene-2-phenyl-4-[4-(4-propylphenyl)piperazin-1-yl]but-2-enoic acid Openeye Name: (Z)-4-oxo-2-phenyl-4-[4-(4-propylphenyl)piperazin-1-yl]but-2-enoic acid CAS Name: (Z)-4-oxo-2-phenyl-4-[4-(4-propylphenyl)-1-piperazinyl]-2-butenoic acid IUPAC Name: (Z)-4-oxo-2-phenyl-4-[4-(4-propylphenyl)piperazin-1-yl]but-2-enoic acid Traditional Name: (Z)-4-keto-2-phenyl-4-[4-(4-propylphenyl)piperazino]but-2-enoic acid Formula: C23H26N2O3 MolecularWeight: 378.46414

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)N2CCN(CC2)C(=O)C=C(C3=CC=CC=C3)C(=O)O

Isomeric SMILES

CCCC1=CC=C(C=C1)N2CCN(CC2)C(=O)/C=C(/C3=CC=CC=C3)\C(=O)O

InChI

InChI=1S/C23H26N2O3/c1-2-6-18-9-11-20(12-10-18)24-13-15-25(16-14-24)22(26)17-21(23(27)28)19-7-4-3-5-8-19/h3-5,7-12,17H,2,6,13-16H2,1H3,(H,27,28)/b21-17-