ethyl (E)-2-(2-chloranylpyridin-3-yl)carbonyl-3-(pyridin-2-ylamino)prop-2-enoate

Systemtic Name: ethyl (E)-2-(2-chloranylpyridin-3-yl)carbonyl-3-(pyridin-2-ylamino)prop-2-enoate Openeye Name: ethyl (E)-2-(2-chloropyridine-3-carbonyl)-3-(2-pyridylamino)prop-2-enoate CAS Name: (E)-2-[(2-chloro-3-pyridinyl)-oxomethyl]-3-(2-pyridinylamino)-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-2-(2-chloropyridine-3-carbonyl)-3-(pyridin-2-ylamino)prop-2-enoate Traditional Name: (E)-2-(2-chloronicotinoyl)-3-(2-pyridylamino)acrylic acid ethyl ester Formula: C16H14ClN3O3 MolecularWeight: 331.75366

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CNC1=CC=CC=N1)C(=O)C2=C(N=CC=C2)Cl

Isomeric SMILES

CCOC(=O)/C(=C/NC1=CC=CC=N1)/C(=O)C2=C(N=CC=C2)Cl

InChI

InChI=1S/C16H14ClN3O3/c1-2-23-16(22)12(10-20-13-7-3-4-8-18-13)14(21)11-6-5-9-19-15(11)17/h3-10H,2H2,1H3,(H,18,20)/b12-10+