3-(2-chloranyl-5-nitro-phenoxy)-N-methyl-pentan-1-amine

Systemtic Name: 3-(2-chloranyl-5-nitro-phenoxy)-N-methyl-pentan-1-amine Openeye Name: 3-(2-chloro-5-nitro-phenoxy)-N-methyl-pentan-1-amine CAS Name: 3-(2-chloro-5-nitrophenoxy)-N-methyl-1-pentanamine IUPAC Name: 3-(2-chloro-5-nitrophenoxy)-N-methylpentan-1-amine Traditional Name: 3-(2-chloro-5-nitro-phenoxy)pentyl-methyl-amine Formula: C12H17ClN2O3 MolecularWeight: 272.72798

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CCNC)OC1=C(C=CC(=C1)[N+](=O)[O-])Cl

Isomeric SMILES

CCC(CCNC)OC1=C(C=CC(=C1)[N+](=O)[O-])Cl

InChI

InChI=1S/C12H17ClN2O3/c1-3-10(6-7-14-2)18-12-8-9(15(16)17)4-5-11(12)13/h4-5,8,10,14H,3,6-7H2,1-2H3