2-chloranyl-6-(3-ethoxy-3-methyl-pent-1-ynyl)-4-nitro-aniline

Systemtic Name: 2-chloranyl-6-(3-ethoxy-3-methyl-pent-1-ynyl)-4-nitro-aniline Openeye Name: 2-chloro-6-(3-ethoxy-3-methyl-pent-1-ynyl)-4-nitro-aniline CAS Name: 2-chloro-6-(3-ethoxy-3-methylpent-1-ynyl)-4-nitroaniline IUPAC Name: 2-chloro-6-(3-ethoxy-3-methylpent-1-ynyl)-4-nitroaniline Traditional Name: [2-chloro-6-(3-ethoxy-3-methyl-pent-1-ynyl)-4-nitro-phenyl]amine Formula: C14H17ClN2O3 MolecularWeight: 296.74938

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C#CC1=CC(=CC(=C1N)Cl)[N+](=O)[O-])OCC

Isomeric SMILES

CCC(C)(C#CC1=CC(=CC(=C1N)Cl)[N+](=O)[O-])OCC

InChI

InChI=1S/C14H17ClN2O3/c1-4-14(3,20-5-2)7-6-10-8-11(17(18)19)9-12(15)13(10)16/h8-9H,4-5,16H2,1-3H3