methyl (E)-2-[(E)-3-azanyl-3-oxidanylidene-1-pyridin-4-yl-prop-1-en-2-yl]-3-(3-chloranyl-4,5-dimethoxy-phenyl)but-2-enoate

Systemtic Name: methyl (E)-2-[(E)-3-azanyl-3-oxidanylidene-1-pyridin-4-yl-prop-1-en-2-yl]-3-(3-chloranyl-4,5-dimethoxy-phenyl)but-2-enoate Openeye Name: methyl (E)-2-[(E)-1-carbamoyl-2-(4-pyridyl)vinyl]-3-(3-chloro-4,5-dimethoxy-phenyl)but-2-enoate CAS Name: (E)-2-[(E)-3-amino-3-oxo-1-pyridin-4-ylprop-1-en-2-yl]-3-(3-chloro-4,5-dimethoxyphenyl)-2-butenoic acid methyl ester IUPAC Name: methyl (E)-2-[(E)-3-amino-3-oxo-1-pyridin-4-ylprop-1-en-2-yl]-3-(3-chloro-4,5-dimethoxyphenyl)but-2-enoate Traditional Name: (E)-2-[(E)-1-carbamoyl-2-(4-pyridyl)vinyl]-3-(3-chloro-4,5-dimethoxy-phenyl)but-2-enoic acid methyl ester Formula: C21H21ClN2O5 MolecularWeight: 416.85484

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C(=CC1=CC=NC=C1)C(=O)N)C(=O)OC)C2=CC(=C(C(=C2)Cl)OC)OC

Isomeric SMILES

C/C(=C(/C(=C\C1=CC=NC=C1)/C(=O)N)\C(=O)OC)/C2=CC(=C(C(=C2)Cl)OC)OC

InChI

InChI=1S/C21H21ClN2O5/c1-12(14-10-16(22)19(28-3)17(11-14)27-2)18(21(26)29-4)15(20(23)25)9-13-5-7-24-8-6-13/h5-11H,1-4H3,(H2,23,25)/b15-9+,18-12+