sodium (Z)-2-azanyl-5-(4-ethylphenyl)-5-(4-fluorophenyl)pent-4-enoate

Systemtic Name: sodium (Z)-2-azanyl-5-(4-ethylphenyl)-5-(4-fluorophenyl)pent-4-enoate Openeye Name: sodium (Z)-2-amino-5-(4-ethylphenyl)-5-(4-fluorophenyl)pent-4-enoate CAS Name: sodium (Z)-2-amino-5-(4-ethylphenyl)-5-(4-fluorophenyl)-4-pentenoate IUPAC Name: sodium (Z)-2-amino-5-(4-ethylphenyl)-5-(4-fluorophenyl)pent-4-enoate Traditional Name: sodium (Z)-2-amino-5-(4-ethylphenyl)-5-(4-fluorophenyl)pent-4-enoate Formula: C19H19FNNaO2 MolecularWeight: 335.347833

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=CCC(C(=O)[O-])N)C2=CC=C(C=C2)F.[Na+]

Isomeric SMILES

CCC1=CC=C(C=C1)/C(=C/CC(C(=O)[O-])N)/C2=CC=C(C=C2)F.[Na+]

InChI

InChI=1S/C19H20FNO2.Na/c1-2-13-3-5-14(6-4-13)17(11-12-18(21)19(22)23)15-7-9-16(20)10-8-15;/h3-11,18H,2,12,21H2,1H3,(H,22,23);/q;+1/p-1/b17-11-;