sodium 4-[[(Z)-(3-chloranyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)-(2-fluorophenyl)methyl]amino]butanoate

Systemtic Name: sodium 4-[[(Z)-(3-chloranyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)-(2-fluorophenyl)methyl]amino]butanoate Openeye Name: sodium 4-[[(Z)-(3-chloro-6-oxo-cyclohexa-2,4-dien-1-ylidene)-(2-fluorophenyl)methyl]amino]butanoate CAS Name: sodium 4-[[(Z)-(3-chloro-6-oxo-1-cyclohexa-2,4-dienylidene)-(2-fluorophenyl)methyl]amino]butanoate IUPAC Name: sodium 4-[[(Z)-(3-chloro-6-oxocyclohexa-2,4-dien-1-ylidene)-(2-fluorophenyl)methyl]amino]butanoate Traditional Name: sodium 4-[[(Z)-(3-chloro-6-keto-cyclohexa-2,4-dien-1-ylidene)-(2-fluorophenyl)methyl]amino]butyrate Formula: C17H14ClFNNaO3 MolecularWeight: 357.739133

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=C2C=C(C=CC2=O)Cl)NCCCC(=O)[O-])F.[Na+]

Isomeric SMILES

C1=CC=C(C(=C1)/C(=C/2\C=C(C=CC2=O)Cl)/NCCCC(=O)[O-])F.[Na+]

InChI

InChI=1S/C17H15ClFNO3.Na/c18-11-7-8-15(21)13(10-11)17(20-9-3-6-16(22)23)12-4-1-2-5-14(12)19;/h1-2,4-5,7-8,10,20H,3,6,9H2,(H,22,23);/q;+1/p-1/b17-13-;