methyl 2-[4-[(E)-3-oxidanylidene-3-(pyridin-4-ylmethylamino)prop-1-enyl]phenoxy]ethanoate

Systemtic Name: methyl 2-[4-[(E)-3-oxidanylidene-3-(pyridin-4-ylmethylamino)prop-1-enyl]phenoxy]ethanoate Openeye Name: methyl 2-[4-[(E)-3-oxo-3-(4-pyridylmethylamino)prop-1-enyl]phenoxy]acetate CAS Name: 2-[4-[(E)-3-oxo-3-(pyridin-4-ylmethylamino)prop-1-enyl]phenoxy]acetic acid methyl ester IUPAC Name: methyl 2-[4-[(E)-3-oxo-3-(pyridin-4-ylmethylamino)prop-1-enyl]phenoxy]acetate Traditional Name: 2-[4-[(E)-3-keto-3-(4-pyridylmethylamino)prop-1-enyl]phenoxy]acetic acid methyl ester Formula: C18H18N2O4 MolecularWeight: 326.34652

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)COC1=CC=C(C=C1)C=CC(=O)NCC2=CC=NC=C2

Isomeric SMILES

COC(=O)COC1=CC=C(C=C1)/C=C/C(=O)NCC2=CC=NC=C2

InChI

InChI=1S/C18H18N2O4/c1-23-18(22)13-24-16-5-2-14(3-6-16)4-7-17(21)20-12-15-8-10-19-11-9-15/h2-11H,12-13H2,1H3,(H,20,21)/b7-4+