N-[[4-[(3-methylpiperidin-1-yl)methyl]phenyl]methyl]-2-(2-nitrophenoxy)ethanamide

Systemtic Name: N-[[4-[(3-methylpiperidin-1-yl)methyl]phenyl]methyl]-2-(2-nitrophenoxy)ethanamide Openeye Name: N-[[4-[(3-methyl-1-piperidyl)methyl]phenyl]methyl]-2-(2-nitrophenoxy)acetamide CAS Name: N-[[4-[(3-methyl-1-piperidinyl)methyl]phenyl]methyl]-2-(2-nitrophenoxy)acetamide IUPAC Name: N-[[4-[(3-methylpiperidin-1-yl)methyl]phenyl]methyl]-2-(2-nitrophenoxy)acetamide Traditional Name: N-[4-[(3-methylpiperidino)methyl]benzyl]-2-(2-nitrophenoxy)acetamide Formula: C22H27N3O4 MolecularWeight: 397.46748

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)CC2=CC=C(C=C2)CNC(=O)COC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CC1CCCN(C1)CC2=CC=C(C=C2)CNC(=O)COC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C22H27N3O4/c1-17-5-4-12-24(14-17)15-19-10-8-18(9-11-19)13-23-22(26)16-29-21-7-3-2-6-20(21)25(27)28/h2-3,6-11,17H,4-5,12-16H2,1H3,(H,23,26)