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

Systemtic Name: N-[5-(1,3-benzoxazol-2-yl)-2-methyl-phenyl]-4-(4-methylpiperidin-1-yl)-3-nitro-benzamide Openeye Name: N-[5-(1,3-benzoxazol-2-yl)-2-methyl-phenyl]-4-(4-methyl-1-piperidyl)-3-nitro-benzamide CAS Name: N-[5-(1,3-benzoxazol-2-yl)-2-methylphenyl]-4-(4-methyl-1-piperidinyl)-3-nitrobenzamide IUPAC Name: N-[5-(1,3-benzoxazol-2-yl)-2-methylphenyl]-4-(4-methylpiperidin-1-yl)-3-nitrobenzamide Traditional Name: N-[5-(1,3-benzoxazol-2-yl)-2-methyl-phenyl]-4-(4-methylpiperidino)-3-nitro-benzamide Formula: C27H26N4O4 MolecularWeight: 470.51974

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC3=C(C=CC(=C3)C4=NC5=CC=CC=C5O4)C)[N+](=O)[O-]

Isomeric SMILES

CC1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC3=C(C=CC(=C3)C4=NC5=CC=CC=C5O4)C)[N+](=O)[O-]

InChI

InChI=1S/C27H26N4O4/c1-17-11-13-30(14-12-17)23-10-9-19(16-24(23)31(33)34)26(32)28-22-15-20(8-7-18(22)2)27-29-21-5-3-4-6-25(21)35-27/h3-10,15-17H,11-14H2,1-2H3,(H,28,32)