4-chloranyl-N-[2-[2-(4-methylphenoxy)ethylamino]-2-oxidanylidene-ethyl]-3-nitro-benzamide

Systemtic Name: 4-chloranyl-N-[2-[2-(4-methylphenoxy)ethylamino]-2-oxidanylidene-ethyl]-3-nitro-benzamide Openeye Name: 4-chloro-N-[2-[2-(4-methylphenoxy)ethylamino]-2-oxo-ethyl]-3-nitro-benzamide CAS Name: 4-chloro-N-[2-[2-(4-methylphenoxy)ethylamino]-2-oxoethyl]-3-nitrobenzamide IUPAC Name: 4-chloro-N-[2-[2-(4-methylphenoxy)ethylamino]-2-oxoethyl]-3-nitrobenzamide Traditional Name: 4-chloro-N-[2-keto-2-[2-(4-methylphenoxy)ethylamino]ethyl]-3-nitro-benzamide Formula: C18H18ClN3O5 MolecularWeight: 391.80562

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCCNC(=O)CNC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)OCCNC(=O)CNC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C18H18ClN3O5/c1-12-2-5-14(6-3-12)27-9-8-20-17(23)11-21-18(24)13-4-7-15(19)16(10-13)22(25)26/h2-7,10H,8-9,11H2,1H3,(H,20,23)(H,21,24)