2-[3-(1,3-benzoxazol-2-yl)piperidin-1-yl]-N-(4-methyl-2-nitro-phenyl)-2-phenyl-ethanamide

Systemtic Name: 2-[3-(1,3-benzoxazol-2-yl)piperidin-1-yl]-N-(4-methyl-2-nitro-phenyl)-2-phenyl-ethanamide Openeye Name: 2-[3-(1,3-benzoxazol-2-yl)-1-piperidyl]-N-(4-methyl-2-nitro-phenyl)-2-phenyl-acetamide CAS Name: 2-[3-(1,3-benzoxazol-2-yl)-1-piperidinyl]-N-(4-methyl-2-nitrophenyl)-2-phenylacetamide IUPAC Name: 2-[3-(1,3-benzoxazol-2-yl)piperidin-1-yl]-N-(4-methyl-2-nitrophenyl)-2-phenylacetamide Traditional Name: 2-[3-(1,3-benzoxazol-2-yl)piperidino]-N-(4-methyl-2-nitro-phenyl)-2-phenyl-acetamide Formula: C27H26N4O4 MolecularWeight: 470.51974

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C(C2=CC=CC=C2)N3CCCC(C3)C4=NC5=CC=CC=C5O4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C(C2=CC=CC=C2)N3CCCC(C3)C4=NC5=CC=CC=C5O4)[N+](=O)[O-]

InChI

InChI=1S/C27H26N4O4/c1-18-13-14-21(23(16-18)31(33)34)28-26(32)25(19-8-3-2-4-9-19)30-15-7-10-20(17-30)27-29-22-11-5-6-12-24(22)35-27/h2-6,8-9,11-14,16,20,25H,7,10,15,17H2,1H3,(H,28,32)