4-[[(4-ethoxy-3-methoxy-phenyl)methyl-ethyl-amino]methyl]-3-nitro-benzamide

Systemtic Name: 4-[[(4-ethoxy-3-methoxy-phenyl)methyl-ethyl-amino]methyl]-3-nitro-benzamide Openeye Name: 4-[[(4-ethoxy-3-methoxy-phenyl)methyl-ethyl-amino]methyl]-3-nitro-benzamide CAS Name: 4-[[(4-ethoxy-3-methoxyphenyl)methyl-ethylamino]methyl]-3-nitrobenzamide IUPAC Name: 4-[[(4-ethoxy-3-methoxyphenyl)methyl-ethylamino]methyl]-3-nitrobenzamide Traditional Name: 4-[[(4-ethoxy-3-methoxy-benzyl)-ethyl-amino]methyl]-3-nitro-benzamide Formula: C20H25N3O5 MolecularWeight: 387.4296

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC(=C(C=C1)OCC)OC)CC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

CCN(CC1=CC(=C(C=C1)OCC)OC)CC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C20H25N3O5/c1-4-22(12-14-6-9-18(28-5-2)19(10-14)27-3)13-16-8-7-15(20(21)24)11-17(16)23(25)26/h6-11H,4-5,12-13H2,1-3H3,(H2,21,24)