N-[3-(5,7-dimethyl-1,3-benzoxazol-2-yl)-2-methyl-phenyl]-3-nitro-4-piperidin-1-yl-benzamide

Systemtic Name: N-[3-(5,7-dimethyl-1,3-benzoxazol-2-yl)-2-methyl-phenyl]-3-nitro-4-piperidin-1-yl-benzamide Openeye Name: N-[3-(5,7-dimethyl-1,3-benzoxazol-2-yl)-2-methyl-phenyl]-3-nitro-4-(1-piperidyl)benzamide CAS Name: N-[3-(5,7-dimethyl-1,3-benzoxazol-2-yl)-2-methylphenyl]-3-nitro-4-(1-piperidinyl)benzamide IUPAC Name: N-[3-(5,7-dimethyl-1,3-benzoxazol-2-yl)-2-methylphenyl]-3-nitro-4-piperidin-1-ylbenzamide Traditional Name: N-[3-(5,7-dimethyl-1,3-benzoxazol-2-yl)-2-methyl-phenyl]-3-nitro-4-piperidino-benzamide Formula: C28H28N4O4 MolecularWeight: 484.54632

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)N=C(O2)C3=C(C(=CC=C3)NC(=O)C4=CC(=C(C=C4)N5CCCCC5)[N+](=O)[O-])C)C

Isomeric SMILES

CC1=CC(=C2C(=C1)N=C(O2)C3=C(C(=CC=C3)NC(=O)C4=CC(=C(C=C4)N5CCCCC5)[N+](=O)[O-])C)C

InChI

InChI=1S/C28H28N4O4/c1-17-14-18(2)26-23(15-17)30-28(36-26)21-8-7-9-22(19(21)3)29-27(33)20-10-11-24(25(16-20)32(34)35)31-12-5-4-6-13-31/h7-11,14-16H,4-6,12-13H2,1-3H3,(H,29,33)