(2S)-2-[2-methoxy-4-[(E)-2-pyridin-4-ylethenyl]phenoxy]butanoate

Systemtic Name: (2S)-2-[2-methoxy-4-[(E)-2-pyridin-4-ylethenyl]phenoxy]butanoate Openeye Name: (2S)-2-[2-methoxy-4-[(E)-2-(4-pyridyl)vinyl]phenoxy]butanoate CAS Name: (2S)-2-[2-methoxy-4-[(E)-2-pyridin-4-ylethenyl]phenoxy]butanoate IUPAC Name: (2S)-2-[2-methoxy-4-[(E)-2-pyridin-4-ylethenyl]phenoxy]butanoate Traditional Name: (2S)-2-[2-methoxy-4-[(E)-2-(4-pyridyl)vinyl]phenoxy]butyrate Formula: C18H18NO4- MolecularWeight: 312.33982

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)[O-])OC1=C(C=C(C=C1)C=CC2=CC=NC=C2)OC

Isomeric SMILES

CC[C@@H](C(=O)[O-])OC1=C(C=C(C=C1)/C=C/C2=CC=NC=C2)OC

InChI

InChI=1S/C18H19NO4/c1-3-15(18(20)21)23-16-7-6-14(12-17(16)22-2)5-4-13-8-10-19-11-9-13/h4-12,15H,3H2,1-2H3,(H,20,21)/p-1/b5-4+/t15-/m0/s1