[2-(2,2-dimethyl-3-oxidanylidene-4H-quinoxalin-1-yl)-2-oxidanylidene-ethyl] (E)-3-(3-chloranyl-4-methyl-phenyl)prop-2-enoate

Systemtic Name: [2-(2,2-dimethyl-3-oxidanylidene-4H-quinoxalin-1-yl)-2-oxidanylidene-ethyl] (E)-3-(3-chloranyl-4-methyl-phenyl)prop-2-enoate Openeye Name: [2-(2,2-dimethyl-3-oxo-4H-quinoxalin-1-yl)-2-oxo-ethyl] (E)-3-(3-chloro-4-methyl-phenyl)prop-2-enoate CAS Name: (E)-3-(3-chloro-4-methylphenyl)-2-propenoic acid [2-(2,2-dimethyl-3-oxo-4H-quinoxalin-1-yl)-2-oxoethyl] ester IUPAC Name: [2-(2,2-dimethyl-3-oxo-4H-quinoxalin-1-yl)-2-oxoethyl] (E)-3-(3-chloro-4-methylphenyl)prop-2-enoate Traditional Name: (E)-3-(3-chloro-4-methyl-phenyl)acrylic acid [2-keto-2-(3-keto-2,2-dimethyl-4H-quinoxalin-1-yl)ethyl] ester Formula: C22H21ClN2O4 MolecularWeight: 412.86614

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C=CC(=O)OCC(=O)N2C3=CC=CC=C3NC(=O)C2(C)C)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)/C=C/C(=O)OCC(=O)N2C3=CC=CC=C3NC(=O)C2(C)C)Cl

InChI

InChI=1S/C22H21ClN2O4/c1-14-8-9-15(12-16(14)23)10-11-20(27)29-13-19(26)25-18-7-5-4-6-17(18)24-21(28)22(25,2)3/h4-12H,13H2,1-3H3,(H,24,28)/b11-10+