[3-(1,3-benzoxazol-2-yl)piperidin-1-yl]-[4-(3-methylpiperidin-1-yl)-3-nitro-phenyl]methanone

Systemtic Name: [3-(1,3-benzoxazol-2-yl)piperidin-1-yl]-[4-(3-methylpiperidin-1-yl)-3-nitro-phenyl]methanone Openeye Name: [3-(1,3-benzoxazol-2-yl)-1-piperidyl]-[4-(3-methyl-1-piperidyl)-3-nitro-phenyl]methanone CAS Name: [3-(1,3-benzoxazol-2-yl)-1-piperidinyl]-[4-(3-methyl-1-piperidinyl)-3-nitrophenyl]methanone IUPAC Name: [3-(1,3-benzoxazol-2-yl)piperidin-1-yl]-[4-(3-methylpiperidin-1-yl)-3-nitrophenyl]methanone Traditional Name: [3-(1,3-benzoxazol-2-yl)piperidino]-[4-(3-methylpiperidino)-3-nitro-phenyl]methanone Formula: C25H28N4O4 MolecularWeight: 448.51422

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C2=C(C=C(C=C2)C(=O)N3CCCC(C3)C4=NC5=CC=CC=C5O4)[N+](=O)[O-]

Isomeric SMILES

CC1CCCN(C1)C2=C(C=C(C=C2)C(=O)N3CCCC(C3)C4=NC5=CC=CC=C5O4)[N+](=O)[O-]

InChI

InChI=1S/C25H28N4O4/c1-17-6-4-12-27(15-17)21-11-10-18(14-22(21)29(31)32)25(30)28-13-5-7-19(16-28)24-26-20-8-2-3-9-23(20)33-24/h2-3,8-11,14,17,19H,4-7,12-13,15-16H2,1H3