[4-(5-chloranyl-2-nitro-phenoxy)-4-phenyl-butyl]carbamic acid

Systemtic Name: [4-(5-chloranyl-2-nitro-phenoxy)-4-phenyl-butyl]carbamic acid Openeye Name: [4-(5-chloro-2-nitro-phenoxy)-4-phenyl-butyl]carbamic acid CAS Name: [4-(5-chloro-2-nitrophenoxy)-4-phenylbutyl]carbamic acid IUPAC Name: [4-(5-chloro-2-nitrophenoxy)-4-phenylbutyl]carbamic acid Traditional Name: [4-(5-chloro-2-nitro-phenoxy)-4-phenyl-butyl]carbamic acid Formula: C17H17ClN2O5 MolecularWeight: 364.78028

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CCCNC(=O)O)OC2=C(C=CC(=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C(CCCNC(=O)O)OC2=C(C=CC(=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C17H17ClN2O5/c18-13-8-9-14(20(23)24)16(11-13)25-15(7-4-10-19-17(21)22)12-5-2-1-3-6-12/h1-3,5-6,8-9,11,15,19H,4,7,10H2,(H,21,22)