(E)-5-(4-chlorophenyl)-3-methyl-5-phenylazanyl-pent-2-enoic acid

Systemtic Name: (E)-5-(4-chlorophenyl)-3-methyl-5-phenylazanyl-pent-2-enoic acid Openeye Name: (E)-5-anilino-5-(4-chlorophenyl)-3-methyl-pent-2-enoic acid CAS Name: (E)-5-anilino-5-(4-chlorophenyl)-3-methyl-2-pentenoic acid IUPAC Name: (E)-5-anilino-5-(4-chlorophenyl)-3-methylpent-2-enoic acid Traditional Name: (E)-5-anilino-5-(4-chlorophenyl)-3-methyl-pent-2-enoic acid Formula: C18H18ClNO2 MolecularWeight: 315.79402

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)O)CC(C1=CC=C(C=C1)Cl)NC2=CC=CC=C2

Isomeric SMILES

C/C(=C\C(=O)O)/CC(C1=CC=C(C=C1)Cl)NC2=CC=CC=C2

InChI

InChI=1S/C18H18ClNO2/c1-13(12-18(21)22)11-17(14-7-9-15(19)10-8-14)20-16-5-3-2-4-6-16/h2-10,12,17,20H,11H2,1H3,(H,21,22)/b13-12+