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

Systemtic Name: N-[2-methyl-5-(5-propan-2-yl-1,3-benzoxazol-2-yl)phenyl]-3-nitro-4-piperidin-1-yl-benzamide Openeye Name: N-[5-(5-isopropyl-1,3-benzoxazol-2-yl)-2-methyl-phenyl]-3-nitro-4-(1-piperidyl)benzamide CAS Name: N-[2-methyl-5-(5-propan-2-yl-1,3-benzoxazol-2-yl)phenyl]-3-nitro-4-(1-piperidinyl)benzamide IUPAC Name: N-[2-methyl-5-(5-propan-2-yl-1,3-benzoxazol-2-yl)phenyl]-3-nitro-4-piperidin-1-ylbenzamide Traditional Name: N-[5-(5-isopropyl-1,3-benzoxazol-2-yl)-2-methyl-phenyl]-3-nitro-4-piperidino-benzamide Formula: C29H30N4O4 MolecularWeight: 498.5729

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NC3=C(O2)C=CC(=C3)C(C)C)NC(=O)C4=CC(=C(C=C4)N5CCCCC5)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NC3=C(O2)C=CC(=C3)C(C)C)NC(=O)C4=CC(=C(C=C4)N5CCCCC5)[N+](=O)[O-]

InChI

InChI=1S/C29H30N4O4/c1-18(2)20-10-12-27-24(15-20)31-29(37-27)22-8-7-19(3)23(16-22)30-28(34)21-9-11-25(26(17-21)33(35)36)32-13-5-4-6-14-32/h7-12,15-18H,4-6,13-14H2,1-3H3,(H,30,34)