5-[[(Z)-(3-fluoranyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)-phenyl-methyl]amino]pentanoic acid

Systemtic Name: 5-[[(Z)-(3-fluoranyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)-phenyl-methyl]amino]pentanoic acid Openeye Name: 5-[[(Z)-(3-fluoro-6-oxo-cyclohexa-2,4-dien-1-ylidene)-phenyl-methyl]amino]pentanoic acid CAS Name: 5-[[(Z)-(3-fluoro-6-oxo-1-cyclohexa-2,4-dienylidene)-phenylmethyl]amino]pentanoic acid IUPAC Name: 5-[[(Z)-(3-fluoro-6-oxocyclohexa-2,4-dien-1-ylidene)-phenylmethyl]amino]pentanoic acid Traditional Name: 5-[[(Z)-(3-fluoro-6-keto-cyclohexa-2,4-dien-1-ylidene)-phenyl-methyl]amino]valeric acid Formula: C18H18FNO3 MolecularWeight: 315.338823

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=C2C=C(C=CC2=O)F)NCCCCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)/C(=C/2\C=C(C=CC2=O)F)/NCCCCC(=O)O

InChI

InChI=1S/C18H18FNO3/c19-14-9-10-16(21)15(12-14)18(13-6-2-1-3-7-13)20-11-5-4-8-17(22)23/h1-3,6-7,9-10,12,20H,4-5,8,11H2,(H,22,23)/b18-15-