N-[3-(5-ethyl-1,3-benzoxazol-2-yl)phenyl]-4-(4-methylpiperidin-1-yl)-3-nitro-benzamide

Systemtic Name: N-[3-(5-ethyl-1,3-benzoxazol-2-yl)phenyl]-4-(4-methylpiperidin-1-yl)-3-nitro-benzamide Openeye Name: N-[3-(5-ethyl-1,3-benzoxazol-2-yl)phenyl]-4-(4-methyl-1-piperidyl)-3-nitro-benzamide CAS Name: N-[3-(5-ethyl-1,3-benzoxazol-2-yl)phenyl]-4-(4-methyl-1-piperidinyl)-3-nitrobenzamide IUPAC Name: N-[3-(5-ethyl-1,3-benzoxazol-2-yl)phenyl]-4-(4-methylpiperidin-1-yl)-3-nitrobenzamide Traditional Name: N-[3-(5-ethyl-1,3-benzoxazol-2-yl)phenyl]-4-(4-methylpiperidino)-3-nitro-benzamide Formula: C28H28N4O4 MolecularWeight: 484.54632

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)OC(=N2)C3=CC(=CC=C3)NC(=O)C4=CC(=C(C=C4)N5CCC(CC5)C)[N+](=O)[O-]

Isomeric SMILES

CCC1=CC2=C(C=C1)OC(=N2)C3=CC(=CC=C3)NC(=O)C4=CC(=C(C=C4)N5CCC(CC5)C)[N+](=O)[O-]

InChI

InChI=1S/C28H28N4O4/c1-3-19-7-10-26-23(15-19)30-28(36-26)21-5-4-6-22(16-21)29-27(33)20-8-9-24(25(17-20)32(34)35)31-13-11-18(2)12-14-31/h4-10,15-18H,3,11-14H2,1-2H3,(H,29,33)