4-chloranyl-2-[[(E)-3-phenylbut-2-enoyl]amino]benzoic acid

Systemtic Name: 4-chloranyl-2-[[(E)-3-phenylbut-2-enoyl]amino]benzoic acid Openeye Name: 4-chloro-2-[[(E)-3-phenylbut-2-enoyl]amino]benzoic acid CAS Name: 4-chloro-2-[[(E)-1-oxo-3-phenylbut-2-enyl]amino]benzoic acid IUPAC Name: 4-chloro-2-[[(E)-3-phenylbut-2-enoyl]amino]benzoic acid Traditional Name: 4-chloro-2-[[(E)-3-phenylbut-2-enoyl]amino]benzoic acid Formula: C17H14ClNO3 MolecularWeight: 315.75096

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)NC1=C(C=CC(=C1)Cl)C(=O)O)C2=CC=CC=C2

Isomeric SMILES

C/C(=C\C(=O)NC1=C(C=CC(=C1)Cl)C(=O)O)/C2=CC=CC=C2

InChI

InChI=1S/C17H14ClNO3/c1-11(12-5-3-2-4-6-12)9-16(20)19-15-10-13(18)7-8-14(15)17(21)22/h2-10H,1H3,(H,19,20)(H,21,22)/b11-9+