4-[[4-[butyl(ethyl)amino]-6-methyl-3-nitro-pyridin-2-yl]amino]-3-chloranyl-benzenecarbonitrile

Systemtic Name: 4-[[4-[butyl(ethyl)amino]-6-methyl-3-nitro-pyridin-2-yl]amino]-3-chloranyl-benzenecarbonitrile Openeye Name: 4-[[4-[butyl(ethyl)amino]-6-methyl-3-nitro-2-pyridyl]amino]-3-chloro-benzonitrile CAS Name: 4-[[4-[butyl(ethyl)amino]-6-methyl-3-nitro-2-pyridinyl]amino]-3-chlorobenzonitrile IUPAC Name: 4-[[4-[butyl(ethyl)amino]-6-methyl-3-nitropyridin-2-yl]amino]-3-chlorobenzonitrile Traditional Name: 4-[[4-[butyl(ethyl)amino]-6-methyl-3-nitro-2-pyridyl]amino]-3-chloro-benzonitrile Formula: C19H22ClN5O2 MolecularWeight: 387.86328

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC)C1=CC(=NC(=C1[N+](=O)[O-])NC2=C(C=C(C=C2)C#N)Cl)C

Isomeric SMILES

CCCCN(CC)C1=CC(=NC(=C1[N+](=O)[O-])NC2=C(C=C(C=C2)C#N)Cl)C

InChI

InChI=1S/C19H22ClN5O2/c1-4-6-9-24(5-2)17-10-13(3)22-19(18(17)25(26)27)23-16-8-7-14(12-21)11-15(16)20/h7-8,10-11H,4-6,9H2,1-3H3,(H,22,23)