N-[2-(3-methylphenoxy)phenyl]-4-(4-methylpiperidin-1-yl)-3-nitro-benzamide

Systemtic Name: N-[2-(3-methylphenoxy)phenyl]-4-(4-methylpiperidin-1-yl)-3-nitro-benzamide Openeye Name: N-[2-(3-methylphenoxy)phenyl]-4-(4-methyl-1-piperidyl)-3-nitro-benzamide CAS Name: N-[2-(3-methylphenoxy)phenyl]-4-(4-methyl-1-piperidinyl)-3-nitrobenzamide IUPAC Name: N-[2-(3-methylphenoxy)phenyl]-4-(4-methylpiperidin-1-yl)-3-nitrobenzamide Traditional Name: N-[2-(3-methylphenoxy)phenyl]-4-(4-methylpiperidino)-3-nitro-benzamide Formula: C26H27N3O4 MolecularWeight: 445.51028

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC3=CC=CC=C3OC4=CC=CC(=C4)C)[N+](=O)[O-]

Isomeric SMILES

CC1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC3=CC=CC=C3OC4=CC=CC(=C4)C)[N+](=O)[O-]

InChI

InChI=1S/C26H27N3O4/c1-18-12-14-28(15-13-18)23-11-10-20(17-24(23)29(31)32)26(30)27-22-8-3-4-9-25(22)33-21-7-5-6-19(2)16-21/h3-11,16-18H,12-15H2,1-2H3,(H,27,30)