3-[2-(4-chloranyl-2-nitro-phenoxy)ethanoyl-(phenylmethyl)amino]propanamide

Systemtic Name: 3-[2-(4-chloranyl-2-nitro-phenoxy)ethanoyl-(phenylmethyl)amino]propanamide Openeye Name: 3-[benzyl-[2-(4-chloro-2-nitro-phenoxy)acetyl]amino]propanamide CAS Name: 3-[[2-(4-chloro-2-nitrophenoxy)-1-oxoethyl]-(phenylmethyl)amino]propanamide IUPAC Name: 3-[benzyl-[2-(4-chloro-2-nitrophenoxy)acetyl]amino]propanamide Traditional Name: 3-[benzyl-[2-(4-chloro-2-nitro-phenoxy)acetyl]amino]propionamide Formula: C18H18ClN3O5 MolecularWeight: 391.80562

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(CCC(=O)N)C(=O)COC2=C(C=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CN(CCC(=O)N)C(=O)COC2=C(C=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C18H18ClN3O5/c19-14-6-7-16(15(10-14)22(25)26)27-12-18(24)21(9-8-17(20)23)11-13-4-2-1-3-5-13/h1-7,10H,8-9,11-12H2,(H2,20,23)