[3-(1H-benzimidazol-2-yl)piperidin-1-yl]-[4-(3-methylpiperidin-1-yl)-3-nitro-phenyl]methanone

Systemtic Name: [3-(1H-benzimidazol-2-yl)piperidin-1-yl]-[4-(3-methylpiperidin-1-yl)-3-nitro-phenyl]methanone Openeye Name: [3-(1H-benzimidazol-2-yl)-1-piperidyl]-[4-(3-methyl-1-piperidyl)-3-nitro-phenyl]methanone CAS Name: [3-(1H-benzimidazol-2-yl)-1-piperidinyl]-[4-(3-methyl-1-piperidinyl)-3-nitrophenyl]methanone IUPAC Name: [3-(1H-benzimidazol-2-yl)piperidin-1-yl]-[4-(3-methylpiperidin-1-yl)-3-nitrophenyl]methanone Traditional Name: [3-(1H-benzimidazol-2-yl)piperidino]-[4-(3-methylpiperidino)-3-nitro-phenyl]methanone Formula: C25H29N5O3 MolecularWeight: 447.52946

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C2=C(C=C(C=C2)C(=O)N3CCCC(C3)C4=NC5=CC=CC=C5N4)[N+](=O)[O-]

Isomeric SMILES

CC1CCCN(C1)C2=C(C=C(C=C2)C(=O)N3CCCC(C3)C4=NC5=CC=CC=C5N4)[N+](=O)[O-]

InChI

InChI=1S/C25H29N5O3/c1-17-6-4-12-28(15-17)22-11-10-18(14-23(22)30(32)33)25(31)29-13-5-7-19(16-29)24-26-20-8-2-3-9-21(20)27-24/h2-3,8-11,14,17,19H,4-7,12-13,15-16H2,1H3,(H,26,27)