propan-2-yl (E)-3-[4-(2-azanyl-2-oxidanylidene-ethoxy)-3-methoxy-phenyl]-2-cyano-prop-2-enoate

Systemtic Name: propan-2-yl (E)-3-[4-(2-azanyl-2-oxidanylidene-ethoxy)-3-methoxy-phenyl]-2-cyano-prop-2-enoate Openeye Name: isopropyl (E)-3-[4-(2-amino-2-oxo-ethoxy)-3-methoxy-phenyl]-2-cyano-prop-2-enoate CAS Name: (E)-3-[4-(2-amino-2-oxoethoxy)-3-methoxyphenyl]-2-cyano-2-propenoic acid propan-2-yl ester IUPAC Name: propan-2-yl (E)-3-[4-(2-amino-2-oxoethoxy)-3-methoxyphenyl]-2-cyanoprop-2-enoate Traditional Name: (E)-3-[4-(2-amino-2-keto-ethoxy)-3-methoxy-phenyl]-2-cyano-acrylic acid isopropyl ester Formula: C16H18N2O5 MolecularWeight: 318.32452

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C(=CC1=CC(=C(C=C1)OCC(=O)N)OC)C#N

Isomeric SMILES

CC(C)OC(=O)/C(=C/C1=CC(=C(C=C1)OCC(=O)N)OC)/C#N

InChI

InChI=1S/C16H18N2O5/c1-10(2)23-16(20)12(8-17)6-11-4-5-13(14(7-11)21-3)22-9-15(18)19/h4-7,10H,9H2,1-3H3,(H2,18,19)/b12-6+