4-(5-chloranyl-2-nitro-phenoxy)octylcarbamic acid

Systemtic Name: 4-(5-chloranyl-2-nitro-phenoxy)octylcarbamic acid Openeye Name: 4-(5-chloro-2-nitro-phenoxy)octylcarbamic acid CAS Name: 4-(5-chloro-2-nitrophenoxy)octylcarbamic acid IUPAC Name: 4-(5-chloro-2-nitrophenoxy)octylcarbamic acid Traditional Name: 4-(5-chloro-2-nitro-phenoxy)octylcarbamic acid Formula: C15H21ClN2O5 MolecularWeight: 344.79064

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CCCNC(=O)O)OC1=C(C=CC(=C1)Cl)[N+](=O)[O-]

Isomeric SMILES

CCCCC(CCCNC(=O)O)OC1=C(C=CC(=C1)Cl)[N+](=O)[O-]

InChI

InChI=1S/C15H21ClN2O5/c1-2-3-5-12(6-4-9-17-15(19)20)23-14-10-11(16)7-8-13(14)18(21)22/h7-8,10,12,17H,2-6,9H2,1H3,(H,19,20)