N-[[4-[(2,6-dimethylmorpholin-4-yl)methyl]phenyl]methyl]-3-methyl-2-nitro-benzamide

Systemtic Name: N-[[4-[(2,6-dimethylmorpholin-4-yl)methyl]phenyl]methyl]-3-methyl-2-nitro-benzamide Openeye Name: N-[[4-[(2,6-dimethylmorpholin-4-yl)methyl]phenyl]methyl]-3-methyl-2-nitro-benzamide CAS Name: N-[[4-[(2,6-dimethyl-4-morpholinyl)methyl]phenyl]methyl]-3-methyl-2-nitrobenzamide IUPAC Name: N-[[4-[(2,6-dimethylmorpholin-4-yl)methyl]phenyl]methyl]-3-methyl-2-nitrobenzamide Traditional Name: N-[4-[(2,6-dimethylmorpholino)methyl]benzyl]-3-methyl-2-nitro-benzamide Formula: C22H27N3O4 MolecularWeight: 397.46748

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(O1)C)CC2=CC=C(C=C2)CNC(=O)C3=C(C(=CC=C3)C)[N+](=O)[O-]

Isomeric SMILES

CC1CN(CC(O1)C)CC2=CC=C(C=C2)CNC(=O)C3=C(C(=CC=C3)C)[N+](=O)[O-]

InChI

InChI=1S/C22H27N3O4/c1-15-5-4-6-20(21(15)25(27)28)22(26)23-11-18-7-9-19(10-8-18)14-24-12-16(2)29-17(3)13-24/h4-10,16-17H,11-14H2,1-3H3,(H,23,26)