(Z)-4-[4-(3-chloranyl-4-methyl-phenyl)piperazin-1-yl]-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (Z)-4-[4-(3-chloranyl-4-methyl-phenyl)piperazin-1-yl]-4-oxidanylidene-but-2-enoic acid Openeye Name: (Z)-4-[4-(3-chloro-4-methyl-phenyl)piperazin-1-yl]-4-oxo-but-2-enoic acid CAS Name: (Z)-4-[4-(3-chloro-4-methylphenyl)-1-piperazinyl]-4-oxo-2-butenoic acid IUPAC Name: (Z)-4-[4-(3-chloro-4-methylphenyl)piperazin-1-yl]-4-oxobut-2-enoic acid Traditional Name: (Z)-4-[4-(3-chloro-4-methyl-phenyl)piperazino]-4-keto-but-2-enoic acid Formula: C15H17ClN2O3 MolecularWeight: 308.76008

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2CCN(CC2)C(=O)C=CC(=O)O)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)N2CCN(CC2)C(=O)/C=C\C(=O)O)Cl

InChI

InChI=1S/C15H17ClN2O3/c1-11-2-3-12(10-13(11)16)17-6-8-18(9-7-17)14(19)4-5-15(20)21/h2-5,10H,6-9H2,1H3,(H,20,21)/b5-4-