(2-chloranyl-7,8-dimethyl-quinolin-3-yl)methyl (E)-3-(5-nitrofuran-2-yl)prop-2-enoate

Systemtic Name: (2-chloranyl-7,8-dimethyl-quinolin-3-yl)methyl (E)-3-(5-nitrofuran-2-yl)prop-2-enoate Openeye Name: (2-chloro-7,8-dimethyl-3-quinolyl)methyl (E)-3-(5-nitro-2-furyl)prop-2-enoate CAS Name: (E)-3-(5-nitro-2-furanyl)-2-propenoic acid (2-chloro-7,8-dimethyl-3-quinolinyl)methyl ester IUPAC Name: (2-chloro-7,8-dimethylquinolin-3-yl)methyl (E)-3-(5-nitrofuran-2-yl)prop-2-enoate Traditional Name: (E)-3-(5-nitro-2-furyl)acrylic acid (2-chloro-7,8-dimethyl-3-quinolyl)methyl ester Formula: C19H15ClN2O5 MolecularWeight: 386.7858

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=NC(=C(C=C2C=C1)COC(=O)C=CC3=CC=C(O3)[N+](=O)[O-])Cl)C

Isomeric SMILES

CC1=C(C2=NC(=C(C=C2C=C1)COC(=O)/C=C/C3=CC=C(O3)[N+](=O)[O-])Cl)C

InChI

InChI=1S/C19H15ClN2O5/c1-11-3-4-13-9-14(19(20)21-18(13)12(11)2)10-26-17(23)8-6-15-5-7-16(27-15)22(24)25/h3-9H,10H2,1-2H3/b8-6+