4-ethoxy-N-[[(2S)-4-ethyl-2,3-dihydro-1,4-benzoxazin-2-yl]methyl]-N-methyl-3-nitro-benzamide

Systemtic Name: 4-ethoxy-N-[[(2S)-4-ethyl-2,3-dihydro-1,4-benzoxazin-2-yl]methyl]-N-methyl-3-nitro-benzamide Openeye Name: 4-ethoxy-N-[[(2S)-4-ethyl-2,3-dihydro-1,4-benzoxazin-2-yl]methyl]-N-methyl-3-nitro-benzamide CAS Name: 4-ethoxy-N-[[(2S)-4-ethyl-2,3-dihydro-1,4-benzoxazin-2-yl]methyl]-N-methyl-3-nitrobenzamide IUPAC Name: 4-ethoxy-N-[[(2S)-4-ethyl-2,3-dihydro-1,4-benzoxazin-2-yl]methyl]-N-methyl-3-nitrobenzamide Traditional Name: 4-ethoxy-N-[[(2S)-4-ethyl-2,3-dihydro-1,4-benzoxazin-2-yl]methyl]-N-methyl-3-nitro-benzamide Formula: C21H25N3O5 MolecularWeight: 399.4403

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CC(OC2=CC=CC=C21)CN(C)C(=O)C3=CC(=C(C=C3)OCC)[N+](=O)[O-]

Isomeric SMILES

CCN1C[C@H](OC2=CC=CC=C21)CN(C)C(=O)C3=CC(=C(C=C3)OCC)[N+](=O)[O-]

InChI

InChI=1S/C21H25N3O5/c1-4-23-14-16(29-20-9-7-6-8-17(20)23)13-22(3)21(25)15-10-11-19(28-5-2)18(12-15)24(26)27/h6-12,16H,4-5,13-14H2,1-3H3/t16-/m1/s1