ethyl 2-[[2,6-bis(chloranyl)-4-cyano-phenyl]-[4-[butyl(ethyl)amino]-6-methyl-3-nitro-pyridin-2-yl]amino]ethanoate

Systemtic Name: ethyl 2-[[2,6-bis(chloranyl)-4-cyano-phenyl]-[4-[butyl(ethyl)amino]-6-methyl-3-nitro-pyridin-2-yl]amino]ethanoate Openeye Name: ethyl 2-(N-[4-[butyl(ethyl)amino]-6-methyl-3-nitro-2-pyridyl]-2,6-dichloro-4-cyano-anilino)acetate CAS Name: 2-(N-[4-[butyl(ethyl)amino]-6-methyl-3-nitro-2-pyridinyl]-2,6-dichloro-4-cyanoanilino)acetic acid ethyl ester IUPAC Name: ethyl 2-(N-[4-[butyl(ethyl)amino]-6-methyl-3-nitropyridin-2-yl]-2,6-dichloro-4-cyanoanilino)acetate Traditional Name: 2-(N-[4-[butyl(ethyl)amino]-6-methyl-3-nitro-2-pyridyl]-2,6-dichloro-4-cyano-anilino)acetic acid ethyl ester Formula: C23H27Cl2N5O4 MolecularWeight: 508.39758

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC)C1=CC(=NC(=C1[N+](=O)[O-])N(CC(=O)OCC)C2=C(C=C(C=C2Cl)C#N)Cl)C

Isomeric SMILES

CCCCN(CC)C1=CC(=NC(=C1[N+](=O)[O-])N(CC(=O)OCC)C2=C(C=C(C=C2Cl)C#N)Cl)C

InChI

InChI=1S/C23H27Cl2N5O4/c1-5-8-9-28(6-2)19-10-15(4)27-23(22(19)30(32)33)29(14-20(31)34-7-3)21-17(24)11-16(13-26)12-18(21)25/h10-12H,5-9,14H2,1-4H3