[4-(1-adamantylcarbonyl)piperazin-1-yl]-[1-(2-nitrophenyl)piperidin-4-yl]methanone

Systemtic Name: [4-(1-adamantylcarbonyl)piperazin-1-yl]-[1-(2-nitrophenyl)piperidin-4-yl]methanone Openeye Name: [4-(adamantane-1-carbonyl)piperazin-1-yl]-[1-(2-nitrophenyl)-4-piperidyl]methanone CAS Name: [4-[1-adamantyl(oxo)methyl]-1-piperazinyl]-[1-(2-nitrophenyl)-4-piperidinyl]methanone IUPAC Name: [4-(adamantane-1-carbonyl)piperazin-1-yl]-[1-(2-nitrophenyl)piperidin-4-yl]methanone Traditional Name: [4-(adamantane-1-carbonyl)piperazino]-[1-(2-nitrophenyl)-4-piperidyl]methanone Formula: C27H36N4O4 MolecularWeight: 480.59914

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N2CCN(CC2)C(=O)C34CC5CC(C3)CC(C5)C4)C6=CC=CC=C6[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1C(=O)N2CCN(CC2)C(=O)C34CC5CC(C3)CC(C5)C4)C6=CC=CC=C6[N+](=O)[O-]

InChI

InChI=1S/C27H36N4O4/c32-25(22-5-7-28(8-6-22)23-3-1-2-4-24(23)31(34)35)29-9-11-30(12-10-29)26(33)27-16-19-13-20(17-27)15-21(14-19)18-27/h1-4,19-22H,5-18H2