3-(5-chloranyl-2-nitro-phenoxy)pentyl-methyl-carbamic acid

Systemtic Name: 3-(5-chloranyl-2-nitro-phenoxy)pentyl-methyl-carbamic acid Openeye Name: 3-(5-chloro-2-nitro-phenoxy)pentyl-methyl-carbamic acid CAS Name: 3-(5-chloro-2-nitrophenoxy)pentyl-methylcarbamic acid IUPAC Name: 3-(5-chloro-2-nitrophenoxy)pentyl-methylcarbamic acid Traditional Name: 3-(5-chloro-2-nitro-phenoxy)pentyl-methyl-carbamic acid Formula: C13H17ClN2O5 MolecularWeight: 316.73748

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17ClN2O5/c1-3-10(6-7-15(2)13(17)18)21-12-8-9(14)4-5-11(12)16(19)20/h4-5,8,10H,3,6-7H2,1-2H3,(H,17,18)