ethyl (E)-3-[4-(3-chloranylpropanoyl)-2,3-dihydroquinoxalin-1-yl]-2-cyano-prop-2-enoate

Systemtic Name: ethyl (E)-3-[4-(3-chloranylpropanoyl)-2,3-dihydroquinoxalin-1-yl]-2-cyano-prop-2-enoate Openeye Name: ethyl (E)-3-[4-(3-chloropropanoyl)-2,3-dihydroquinoxalin-1-yl]-2-cyano-prop-2-enoate CAS Name: (E)-3-[4-(3-chloro-1-oxopropyl)-2,3-dihydroquinoxalin-1-yl]-2-cyano-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[4-(3-chloropropanoyl)-2,3-dihydroquinoxalin-1-yl]-2-cyanoprop-2-enoate Traditional Name: (E)-3-[4-(3-chloropropanoyl)-2,3-dihydroquinoxalin-1-yl]-2-cyano-acrylic acid ethyl ester Formula: C17H18ClN3O3 MolecularWeight: 347.79612

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CN1CCN(C2=CC=CC=C21)C(=O)CCCl)C#N

Isomeric SMILES

CCOC(=O)/C(=C/N1CCN(C2=CC=CC=C21)C(=O)CCCl)/C#N

InChI

InChI=1S/C17H18ClN3O3/c1-2-24-17(23)13(11-19)12-20-9-10-21(16(22)7-8-18)15-6-4-3-5-14(15)20/h3-6,12H,2,7-10H2,1H3/b13-12+