N-[3-(6-methyl-1,3-benzoxazol-2-yl)phenyl]-3-nitro-4-piperidin-1-yl-benzamide

Systemtic Name: N-[3-(6-methyl-1,3-benzoxazol-2-yl)phenyl]-3-nitro-4-piperidin-1-yl-benzamide Openeye Name: N-[3-(6-methyl-1,3-benzoxazol-2-yl)phenyl]-3-nitro-4-(1-piperidyl)benzamide CAS Name: N-[3-(6-methyl-1,3-benzoxazol-2-yl)phenyl]-3-nitro-4-(1-piperidinyl)benzamide IUPAC Name: N-[3-(6-methyl-1,3-benzoxazol-2-yl)phenyl]-3-nitro-4-piperidin-1-ylbenzamide Traditional Name: N-[3-(6-methyl-1,3-benzoxazol-2-yl)phenyl]-3-nitro-4-piperidino-benzamide Formula: C26H24N4O4 MolecularWeight: 456.49316

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(O2)C3=CC(=CC=C3)NC(=O)C4=CC(=C(C=C4)N5CCCCC5)[N+](=O)[O-]

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(O2)C3=CC(=CC=C3)NC(=O)C4=CC(=C(C=C4)N5CCCCC5)[N+](=O)[O-]

InChI

InChI=1S/C26H24N4O4/c1-17-8-10-21-24(14-17)34-26(28-21)19-6-5-7-20(15-19)27-25(31)18-9-11-22(23(16-18)30(32)33)29-12-3-2-4-13-29/h5-11,14-16H,2-4,12-13H2,1H3,(H,27,31)