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

Systemtic Name: 2-[3-(1,3-benzoxazol-2-yl)piperidin-1-yl]-N-(2-methyl-3-nitro-phenyl)ethanamide Openeye Name: 2-[3-(1,3-benzoxazol-2-yl)-1-piperidyl]-N-(2-methyl-3-nitro-phenyl)acetamide CAS Name: 2-[3-(1,3-benzoxazol-2-yl)-1-piperidinyl]-N-(2-methyl-3-nitrophenyl)acetamide IUPAC Name: 2-[3-(1,3-benzoxazol-2-yl)piperidin-1-yl]-N-(2-methyl-3-nitrophenyl)acetamide Traditional Name: 2-[3-(1,3-benzoxazol-2-yl)piperidino]-N-(2-methyl-3-nitro-phenyl)acetamide Formula: C21H22N4O4 MolecularWeight: 394.42378

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])NC(=O)CN2CCCC(C2)C3=NC4=CC=CC=C4O3

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])NC(=O)CN2CCCC(C2)C3=NC4=CC=CC=C4O3

InChI

InChI=1S/C21H22N4O4/c1-14-16(8-4-9-18(14)25(27)28)22-20(26)13-24-11-5-6-15(12-24)21-23-17-7-2-3-10-19(17)29-21/h2-4,7-10,15H,5-6,11-13H2,1H3,(H,22,26)