N-[2-(3-chloranyl-4-methyl-phenyl)-1,3-benzoxazol-5-yl]-3-nitro-4-piperidin-1-yl-benzamide

Systemtic Name: N-[2-(3-chloranyl-4-methyl-phenyl)-1,3-benzoxazol-5-yl]-3-nitro-4-piperidin-1-yl-benzamide Openeye Name: N-[2-(3-chloro-4-methyl-phenyl)-1,3-benzoxazol-5-yl]-3-nitro-4-(1-piperidyl)benzamide CAS Name: N-[2-(3-chloro-4-methylphenyl)-1,3-benzoxazol-5-yl]-3-nitro-4-(1-piperidinyl)benzamide IUPAC Name: N-[2-(3-chloro-4-methylphenyl)-1,3-benzoxazol-5-yl]-3-nitro-4-piperidin-1-ylbenzamide Traditional Name: N-[2-(3-chloro-4-methyl-phenyl)-1,3-benzoxazol-5-yl]-3-nitro-4-piperidino-benzamide Formula: C26H23ClN4O4 MolecularWeight: 490.93822

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NC3=C(O2)C=CC(=C3)NC(=O)C4=CC(=C(C=C4)N5CCCCC5)[N+](=O)[O-])Cl

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NC3=C(O2)C=CC(=C3)NC(=O)C4=CC(=C(C=C4)N5CCCCC5)[N+](=O)[O-])Cl

InChI

InChI=1S/C26H23ClN4O4/c1-16-5-6-18(13-20(16)27)26-29-21-15-19(8-10-24(21)35-26)28-25(32)17-7-9-22(23(14-17)31(33)34)30-11-3-2-4-12-30/h5-10,13-15H,2-4,11-12H2,1H3,(H,28,32)