N-[2-(diethylamino)-2-(3-methoxyphenyl)ethyl]-2-(methylamino)-5-nitro-benzamide

Systemtic Name: N-[2-(diethylamino)-2-(3-methoxyphenyl)ethyl]-2-(methylamino)-5-nitro-benzamide Openeye Name: N-[2-(diethylamino)-2-(3-methoxyphenyl)ethyl]-2-(methylamino)-5-nitro-benzamide CAS Name: N-[2-(diethylamino)-2-(3-methoxyphenyl)ethyl]-2-(methylamino)-5-nitrobenzamide IUPAC Name: N-[2-(diethylamino)-2-(3-methoxyphenyl)ethyl]-2-(methylamino)-5-nitrobenzamide Traditional Name: N-[2-(diethylamino)-2-(3-methoxyphenyl)ethyl]-2-(methylamino)-5-nitro-benzamide Formula: C21H28N4O4 MolecularWeight: 400.47142

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(CNC(=O)C1=C(C=CC(=C1)[N+](=O)[O-])NC)C2=CC(=CC=C2)OC

Isomeric SMILES

CCN(CC)C(CNC(=O)C1=C(C=CC(=C1)[N+](=O)[O-])NC)C2=CC(=CC=C2)OC

InChI

InChI=1S/C21H28N4O4/c1-5-24(6-2)20(15-8-7-9-17(12-15)29-4)14-23-21(26)18-13-16(25(27)28)10-11-19(18)22-3/h7-13,20,22H,5-6,14H2,1-4H3,(H,23,26)